National Institute of Standards and Technology
Computational Chemistry Comparison and Benchmark DataBase
Release 17bSeptember 2015
NIST Standard Reference Database 101
IIntroduction
IIExperimental data
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VCost comparisons
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XOlder CCCBDB versions
XIIGeometries
XIII Vibrations
XIVReaction data
XVEntropy data
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XVIIIon data
XVIIIBad calculations
XIXIndex of properties
XXH-bond dimers
XXIOddities

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I.B.1.e.1.

Index of species in the CCCBDB by IUPAC International Chemical Identifier (INChI)

For information on INChI see http://www.iupac.org/inchi/

Molecules in the CCCBDB

For links to all experimental and calculated data in the CCCBDB click on the name in the following table.
casno formula name InChI InChIkey SMILES sketch other names
12385136 H- Hydrogen atom anion InChI=1S/H/q-1 KLGZELKXQMTEMM-UHFFFAOYSA-N [H-] H-  
12385136 H Hydrogen atom InChI=1S/H YZCKVEUIGOORGS-UHFFFAOYSA-N [H] H   H-atom; Hydrogen; Hydrogen atom; Hydrogen radical
12385136 H+ Hydrogen atom cation InChI=1S/p+1 GPRLSGONYQIRFK-UHFFFAOYSA-N [H+] H+  
16873179 D- Deuterium atom anion InChI=1S/H/q-1/i1+1 KLGZELKXQMTEMM-OUBTZVSYSA-N [2H-] D-  
16873179 D Deuterium atom InChI=1S/H/i1+1 YZCKVEUIGOORGS-OUBTZVSYSA-N [2H] D   Deuterium; Deuterium atom
16873179 D+ Deuterium atom cation InChI=1S/p+1/i/hD GPRLSGONYQIRFK-DYCDLGHISA-N [2H+] D+  
13983205 HD Deuterium hydride InChI=1S/H2/h1H/i1+1 UFHFLCQGNIYNRP-OUBTZVSYSA-N [H][2H]   Deuterium hydride; Deuterium, mol. with hydrogen; Hydrogen-d1
1333740 H2- hydrogen diatomic anion InChI=1S/H2/h1H/q-1 MHQRCAMTVYPALZ-UHFFFAOYSA-N [H][H-]  
1333740 H2 Hydrogen diatomic InChI=1S/H2/h1H UFHFLCQGNIYNRP-UHFFFAOYSA-N [H][H]   Hydrogen; Molecular hydrogen; o-Hydrogen; p-Hydrogen; UN 1966; UN 1049; dihydrogen
1333740 H2+ Hydrogen cation InChI=1S/H2/h1H/q+1 ZZIJOQHRUPVPQC-UHFFFAOYSA-N [H][H+]  
7782390 D2 Deuterium diatomic InChI=1S/H2/h1H/i1+1D UFHFLCQGNIYNRP-VVKOMZTBSA-N [2H][2H]   Deuterium; UN 1957; diduterium
28132481 H3+ hydrogen trimer cation InChI=1S/H3/c1-2-3-1/q+1 RQZCXKHVAUFVMF-UHFFFAOYSA-N  
7440597 He- Helium atom anion InChI=1S/He/q-1 GQCTUJCUOFABIY-UHFFFAOYSA-N [He-] He-  
7440597 He Helium atom InChI=1S/He SWQJXJOGLNCZEY-UHFFFAOYSA-N [He] He   UN 1046; UN 1963; Helium
7440597 He+ Helium atom cation InChI=1S/He/q+1 QLNXTEZOQCZJBA-UHFFFAOYSA-N [He+] He+  
9000184 He2+ helium dimer cation InChI=1S/He2/c1-2/q+1 ZAJTYDXIUNGESO-UHFFFAOYSA-N [He][He+]  
9000219 HeH Helium hydride InChI=1S/HHe/h1H VFSHXFTVUHSLHV-UHFFFAOYSA-N [HeH]  
9000219 HeH+ Helium hydride cation InChI=1S/HHe/h1H/q+1 HSFAAVLNFOAYQX-UHFFFAOYSA-N [He][H+]  
7439932 Li- Lithium atom anion InChI=1S/Li/q-1 VSRVKRSRQFOUEF-UHFFFAOYSA-N [Li-] Li-  
7439932 Li Lithium atom InChI=1S/Li WHXSMMKQMYFTQS-UHFFFAOYSA-N [Li] Li   Lithium; UN 1415
7439932 Li+ Lithium atom cation InChI=1S/Li/q+1 HBBGRARXTFLTSG-UHFFFAOYSA-N [Li+] Li+  
7580678 LiH- lithium hydride anion InChI=1S/Li.H/q-1; ZQPORAMEHYRKLM-UHFFFAOYSA-N [LiH-]  
7580678 LiH Lithium Hydride InChI=1S/Li.H SIAPCJWMELPYOE-UHFFFAOYSA-N [LiH]   Hydrure de lithium; Lithium hydride; Lithium hydride (LiH); UN 1414; UN 2805
7580678 LiH+ lithium hydride cation InChI=1S/Li.H/q+1; HSOYNNFNUCWPIZ-UHFFFAOYSA-N [LiH+]  
7440417 Be- Beryllium atom anion InChI=1S/Be/q-1 MKUXRYYRAPCTSE-UHFFFAOYSA-N [Be-] Be-  
7440417 Be Beryllium atom InChI=1S/Be ATBAMAFKBVZNFJ-UHFFFAOYSA-N [Be] Be   Beryllium; Beryllium-9; Glucinium; Glucinum; Rcra waste number P015; UN 1567
7440417 Be+ Beryllium atom cation InChI=1S/Be/q+1 FSZJGTOCGOQRRE-UHFFFAOYSA-N [Be+] Be+  
13597972 BeH- berylium monohydride anion InChI=1S/Be.H/q-1; XYJSQJZDMXOLES-UHFFFAOYSA-N [BeH-]  
13597972 BeH beryllium monohydride InChI=1S/Be.H AYBCUKQQDUJLQN-UHFFFAOYSA-N [BeH]   Beryllium hydride
13597972 BeH+ beryllium monohydride cation InChI=1S/Be.H/q+1; ZMHJNSGNHYXBAE-UHFFFAOYSA-N [BeH+]  
7787522 BeH2 beryllium dihydride InChI=1S/Be.2H RWASOQSEFLDYLC-UHFFFAOYSA-N [BeH2]   Beryllium hydride
7787522 BeH2+ Beryllium dihydride cation InChI=1S/Be.2H/q+1;; LIYOQPNVGOXTMQ-UHFFFAOYSA-N [BeH2+]  
7787522 BeH2+ Beryllium dihydride cation InChI=1S/Be.2H/q+1;; LIYOQPNVGOXTMQ-UHFFFAOYSA-N [BeH2+]  
7440428 B- Boron atom anion InChI=1S/B/q-1 XGLYHUVZMIRFNT-UHFFFAOYSA-N [B-] B-  
7440428 B Boron atom InChI=1S/B ZOXJGFHDIHLPTG-UHFFFAOYSA-N [B] B   Boron
7440428 B+ Boron atom cation InChI=1S/B/q+1 HYFJXBYGHMZZPQ-UHFFFAOYSA-N [B+] B+  
13766262 BH- boron monohydride anion InChI=1S/BH/h1H/q-1 DBDNZCBRIPTLJF-UHFFFAOYSA-N [BH-]  
13766262 BH Boron monohydride InChI=1S/BH/h1H UWBOAQKPEXKXSU-UHFFFAOYSA-N [BH]   Borane; Borane(1)
13766262 BH+ boron monohydride cation InChI=1S/BH/h1H/q+1 HJCAPRQJPXZNOT-UHFFFAOYSA-N [BH+]  
14452643 BH2- boron dihydride anion InChI=1S/BH2/h1H2/q-1 CBWJKNQKWLEEPG-UHFFFAOYSA-N [BH2-]  
14452643 BH2 boron dihydride InChI=1S/BH2/h1H2 IOCVPZINIZVUIL-UHFFFAOYSA-N [BH2]   BH2 Radical; Borane(2); Boron dihydride
14452643 BH2+ Boron dihydride cation InChI=1S/BH2/h1H2/q+1 RCNJPCYKNBLHDC-UHFFFAOYSA-N [BH2+]  
13283313 BH3- boron trihydride anion InChI=1S/BH3/h1H3/q-1 RAGFTAWPNNEELE-UHFFFAOYSA-N [BH3-]  
13283313 BH3- boron trihydride anion InChI=1S/BH3/h1H3/q-1 RAGFTAWPNNEELE-UHFFFAOYSA-N [BH3-]  
13283313 BH3 boron trihydride InChI=1S/BH3/h1H3 UORVGPXVDQYIDP-UHFFFAOYSA-N B   Borane; Borane(3)
13283313 BH3+ boron trihydride cation InChI=1S/BH3/h1H3/q+1 YXFJCDMOWXLUFT-UHFFFAOYSA-N [BH3+]  
13283313 BH3+ boron trihydride cation InChI=1S/BH3/h1H3/q+1 YXFJCDMOWXLUFT-UHFFFAOYSA-N [BH3+]  
16971292 BH4- borohydride anion InChI=1S/BH4/h1H4/q-1 CROBTXVXNQNKKO-UHFFFAOYSA-N [BH4-]  
16971292 BH4 borohydride InChI=1S/BH4/h1H4 [BH4]  
16971292 BH4 borohydride InChI=1S/BH4/h1H4 [BH4]  
7440440 C- Carbon atom anion InChI=1S/C/q-1 RTNCBHBYULLTCL-UHFFFAOYSA-N [C-] C-  
7440440 C Carbon atom InChI=1S/C OKTJSMMVPCPJKN-UHFFFAOYSA-N [C] C   Carbon
7440440 C+ Carbon atom cation InChI=1S/C/q+1 GKDCRJWYAGBLFY-UHFFFAOYSA-N [C+] C+  
3315375 CH- methylidyne anion InChI=1S/CH/h1H/q-1 VPIURJINGFGPNS-UHFFFAOYSA-N [CH-]  
3315375 CH Methylidyne InChI=1S/CH/h1H VRLIPUYDFBXWCH-UHFFFAOYSA-N [CH]   Methylidyne
3315375 CH+ Methylidyne cation InChI=1S/CH/h1H/q+1 WVVLBIYUCXYYEU-UHFFFAOYSA-N [CH+]  
2465567 CH2- methylene anion InChI=1S/CH2/h1H2/q-1 BBNHULVYDKYRSP-UHFFFAOYSA-N [CH2-]  
2465567 CH2 Methylene InChI=1S/CH2/h1H2 HZVOZRGWRWCICA-UHFFFAOYSA-N [CH2]   Methylene
2465567 CH2 Methylene InChI=1S/CH2/h1H2 HZVOZRGWRWCICA-UHFFFAOYSA-N [CH2]   Methylene
2465567 CH2+ methylene cation InChI=1S/CH2/h1H2/q+1 CCOXZMOGYFFTRT-UHFFFAOYSA-N [CH2+]  
2465567 CH2+ methylene cation InChI=1S/CH2/h1H2/q+1 CCOXZMOGYFFTRT-UHFFFAOYSA-N [CH2+]  
2229074 CH3- methyl anion InChI=1S/CH3/h1H3/q-1 LGRLWUINFJPLSH-UHFFFAOYSA-N [CH3-]  
2229074 CH3 Methyl radical InChI=1S/CH3/h1H3 WCYWZMWISLQXQU-UHFFFAOYSA-N [CH3]   Methyl; Methyl radical
2229074 CH3+ methyl cation InChI=1S/CH3/h1H3/q+1 JUHDUIDUEUEQND-UHFFFAOYSA-N [CH3+]  
74828 CH4 Methane InChI=1S/CH4/h1H4 VNWKTOKETHGBQD-UHFFFAOYSA-N C   Biogas; Fire damp; Marsh gas; Methane; Methyl hydride; R 50; UN 1971; UN 1972
74828 CH4+ Methane cation InChI=1S/CH4/h1H4/q+1 DEMLYXWOPCFOLG-UHFFFAOYSA-N [CH4+]  
74828 CH4+ Methane cation InChI=1S/CH4/h1H4/q+1 DEMLYXWOPCFOLG-UHFFFAOYSA-N [CH4+]  
74828 CH4+ Methane cation InChI=1S/CH4/h1H4/q+1 DEMLYXWOPCFOLG-UHFFFAOYSA-N [CH4+]  
558203 CD4 methane-d4 InChI=1S/CH4/h1H4/i1D4 VNWKTOKETHGBQD-JQYAHLJZSA-N C  
676493 CH3D methane-d InChI=1S/CH4/h1H4/i1D VNWKTOKETHGBQD-MICDWDOJSA-N C  
676551 CH2D2 methane-d2 InChI=1S/CH4/h1H4/i1D2 VNWKTOKETHGBQD-DICFDUPASA-N C  
676802 CHD3 methane-d3 InChI=1S/CH4/h1H4/i1D3 VNWKTOKETHGBQD-FIBGUPNXSA-N C  
17778880 N- Nitrogen atom anion InChI=1S/N/q-1 AODRJISUPXKQJP-UHFFFAOYSA-N [N-] N-  
17778880 N Nitrogen atom InChI=1S/N QJGQUHMNIGDVPM-UHFFFAOYSA-N [N] N   N; Nitrogen atom; Nitrogen radical; nitrogen
17778880 N+ Nitrogen atom cation InChI=1S/N/q+1 DELRCXTYJVVNEW-UHFFFAOYSA-N [N+] N+  
13774920 NH- Imidogen anion InChI=1S/HN/h1H/q-1 NUENPMRHRIHXSZ-UHFFFAOYSA-N [NH-]  
13774920 NH Imidogen InChI=1S/HN/h1H PDCKRJPYJMCOFO-UHFFFAOYSA-N [NH]   Imidogen; Imino
13774920 NH+ imidogen cation InChI=1S/HN/h1H/q+1 RCELGLLFWPQDDS-UHFFFAOYSA-N [NH+]  
15117847 ND2 Amidogen-d2 InChI=1S/H2N/h1H2/i1D2 MDFFNEOEWAXZRQ-DICFDUPASA-N [N]([2H])[2H]   Amidogen-D2
13770406 NH2- amino anion InChI=1S/H2N/h1H2/q-1 HYGWNUKOUCZBND-UHFFFAOYSA-N [NH2-]  
13770406 NH2 Amino radical InChI=1S/H2N/h1H2 MDFFNEOEWAXZRQ-UHFFFAOYSA-N [NH2]   Amidogen; Amino radical
13770406 NH2+ Amino cation InChI=1S/H2N/h1H2/q+1 QTLMMXDMXKCANI-UHFFFAOYSA-N [NH2+]  
13550497 ND3 Ammonia-d3 InChI=1S/H3N/h1H3/i/hD3 QGZKDVFQNNGYKY-ZRLBSURWSA-N N([2H])([2H])[2H]   Ammonia-d3-
7664417 NH3- Ammonia anion InChI=1S/H3N/h1H3/q-1 [NH3-]  
7664417 NH3 Ammonia InChI=1S/H3N/h1H3 QGZKDVFQNNGYKY-UHFFFAOYSA-N N   Ammonia; Ammonia gas; Ammonia, anhydrous; Anhydrous ammonia; Aromatic Ammonia, Vaporole; Nitro-Sil; Spirit of Hartshorn; azane
7664417 NH3+ ammonia cation InChI=1S/H3N/h1H3/q+1 FXDYOSCCLBVICI-UHFFFAOYSA-N [NH3+]  
14798039 NH4+ ammonium cation InChI=1S/H3N/h1H3/p+1 QGZKDVFQNNGYKY-UHFFFAOYSA-O [NH4+]   ammonium
17778802 O- Oxygen atom anion InChI=1S/O/q-1 SUNFGZRUFCAYCR-UHFFFAOYSA-N [O-] O-  
17778802 O Oxygen atom InChI=1S/O QVGXLLKOCUKJST-UHFFFAOYSA-N [O] O   Atomic oxygen; Oxygen; Oxygen atom; Oxygen(sup 3P); Oxygen, atomic; Photooxygen; Singlet oxygen
17778802 O+ Oxygen atom cation InChI=1S/O/q+1 KLZXPVWVDXGFTD-UHFFFAOYSA-N [O+] O+  
13587547 DO Hydroxyl-d InChI=1S/HO/h1H/i1D TUJKJAMUKRIRHC-MICDWDOJSA-N [2HO]   Hydroxyl-D
3352576 OH- hydroxide anion InChI=1S/H2O/h1H2/p-1 XLYOFNOQVPJJNP-UHFFFAOYSA-M [OH-]   Hydroxyl anion; Hydroxyl; hydroxide
3352576 OH Hydroxyl radical InChI=1S/HO/h1H TUJKJAMUKRIRHC-UHFFFAOYSA-N [OH]   Hydroxy radical; Hydroxyl; Hydroxy radical; Hydroxy
3352576 OH+ hydoxyl cation InChI=1S/HO/h1H/q+1 MSCUNRCIQGLERU-UHFFFAOYSA-N [OH+]  
7789200 D2O Deuterium oxide InChI=1S/H2O/h1H2/i/hD2 XLYOFNOQVPJJNP-ZSJDYOACSA-N O([2H])[2H]   Deuterium oxide; Dideuterium oxide; Heavy water; Heavy water-d2; Water(sup 2)-H2; Water, heavy; Water-d2
7732185 H2O- water anion InChI=1S/H2O/h1H2/q-1 UJCLDIPWNLPWIV-UHFFFAOYSA-N [OH2-]  
7732185 H2O- water anion InChI=1S/H2O/h1H2/q-1 UJCLDIPWNLPWIV-UHFFFAOYSA-N [OH2-]  
7732185 H2O Water InChI=1S/H2O/h1H2 XLYOFNOQVPJJNP-UHFFFAOYSA-N O   Dihydrogen oxide; Distilled water; Ice; Water vapor; Water; oxidane
7732185 H2O+ water cation InChI=1S/H2O/h1H2/q+1 RECVMTHOQWMYFX-UHFFFAOYSA-N [OH2+]  
14940637 HDO Water-d1 InChI=1S/H2O/h1H2/i/hD XLYOFNOQVPJJNP-DYCDLGHISA-N O[2H]   Water-D1
13968086 H3O+ hydronium cation InChI=1S/H2O/h1H2/p+1 XLYOFNOQVPJJNP-UHFFFAOYSA-O [OH3+]   oxonium; Oxidanium; hydronium
14762948 F- Fluorine atom anion InChI=1S/FH/h1H/p-1 KRHYYFGTRYWZRS-UHFFFAOYSA-M [F-] F-  
14762948 F Fluorine atom InChI=1S/F YCKRFDGAMUMZLT-UHFFFAOYSA-N F F   Fluorine atom; Fluorine radical; fluorine
14762948 F+ Fluorine atom cation InChI=1S/F/q+1 LMHDQOWNISVSPD-UHFFFAOYSA-N [F+] F+  
14333267 DF Hydrofluoric acid-d InChI=1S/FH/h1H/i/hD KRHYYFGTRYWZRS-DYCDLGHISA-N F[2H]   Deuterium fluoride; Hydrofluoric acid-d
7664393 HF- hydrogen fluoride anion InChI=1S/FH/h1H/q-1 AVYKNYBXEAFLBK-UHFFFAOYSA-N [FH-]  
7664393 HF Hydrogen fluoride InChI=1S/FH/h1H KRHYYFGTRYWZRS-UHFFFAOYSA-N F   Acide fluorhydrique; Acido fluoridrico; Anhydrous hydrofluoric acid; Boron tribromide; Fluoric acid; Fluorowodor; Fluorwasserstoff; Fluorwaterstof; Hydrofluoric acid; Hydrofluoride; Hydrogen fluoride; Rcra waste number U134; Rubigine; UN 1790; UN 1052
7664393 HF+ hydrogen fluoride cation InChI=1S/FH/h1H/q+1 GCZNJFDPFDGYDB-UHFFFAOYSA-N [FH+]  
12206676 H2F+ dihydrogen fluoride cation InChI=1S/FH2/h1H2/q+1 YNESUKSMQODWNS-UHFFFAOYSA-N [FH2+]   fluoronium
7440019 Ne- Neon atom anion InChI=1S/Ne/q-1 OFRAWIXOCFNIFC-UHFFFAOYSA-N [Ne-] Ne-  
7440019 Ne Neon atom InChI=1S/Ne GKAOGPIIYCISHV-UHFFFAOYSA-N [Ne] Ne   UN 1065; UN 1913; Neon
7440019 Ne+ Neon atom cation InChI=1S/Ne/q+1 LANGVOCUTJKVFC-UHFFFAOYSA-N [Ne+] Ne+  
12200656 NeH neon hydrogen InChI=1S/HNe/h1H LBMJGAHVDNLTQZ-UHFFFAOYSA-N [NeH]  
12200656 NeH+ neon hydrogen cation InChI=1S/Ne/p+1 GKAOGPIIYCISHV-UHFFFAOYSA-O [Ne].[H+]  
7440235 Na- Sodium atom anion InChI=1S/Na/q-1 GVGHZEYNQYAORP-UHFFFAOYSA-N [Na-] Na-  
7440235 Na Sodium atom InChI=1S/Na KEAYESYHFKHZAL-UHFFFAOYSA-N [Na] Na   NA 1421; Natrium; Sodium; UN 1429; UN 1428
7440235 Na+ Sodium atom cation InChI=1S/Na/q+1 FKNQFGJONOIPTF-UHFFFAOYSA-N [Na+] Na+  
7646697 NaH- sodium hydride anion InChI=1S/Na.H/q-1; JCISVDFVUVXSDD-UHFFFAOYSA-N [Na][H-]  
7646697 NaH sodium hydride InChI=1S/Na.H MPMYQQHEHYDOCL-UHFFFAOYSA-N [NaH]   NAH 80; Sodium hydride; Sodium hydride (NaH); UN 1427
7646697 NaH+ sodium hydride cation InChI=1S/Na.H/q+1; FYDBACYJBJQTSN-UHFFFAOYSA-N [Na][H+]  
7439954 Mg- Magnesium atom anion InChI=1S/Mg/q-1 XUXSNMMFFZIQRU-UHFFFAOYSA-N [Mg-] Mg-  
7439954 Mg Magnesium atom InChI=1S/Mg FYYHWMGAXLPEAU-UHFFFAOYSA-N [Mg] Mg   Magnesio; Magnesium; Magnesium clippings; Magnesium pellets; Magnesium powder (pyrophoric); Magnesium powdered; Magnesium ribbons; Magnesium turnings; NA 1869; RMC; UN 1418; UN 1869; UN 2950
7439954 Mg+ Magnesium atom cation InChI=1S/Mg/q+1 XYAGEBWLYIDCRX-UHFFFAOYSA-N [Mg+] Mg+  
14332537 MgH- magnesium monohydride anion InChI=1S/Mg.H/q-1; JICOAJQJSYTWQW-UHFFFAOYSA-N [MgH-]  
14332537 MgH- magnesium monohydride anion InChI=1/Mg.H/q-1;/rHMg/h1H/q-1 JICOAJQJSYTWQW-QZXZXGQDNA-N  
14332537 MgH magnesium monohydride InChI=1S/Mg.H RZCHRULKKYOSQS-UHFFFAOYSA-N [MgH]   Magnesium hydride
14332537 MgH+ magnesium monohydride cation InChI=1S/Mg.H/q+1; LMAKMUADRKEOEM-UHFFFAOYSA-N [MgH+]  
14332537 MgH+ magnesium monohydride cation InChI=1/Mg.H/q+1;/rHMg/h1H/q+1 LMAKMUADRKEOEM-CLVLUJLJNA-N [MgH+]  
7693278 MgH2 magnesium dihydride InChI=1S/Mg.2H RSHAOIXHUHAZPM-UHFFFAOYSA-N [MgH2]   Magnesium hydride
7429905 Al- Aluminum atom anion InChI=1S/Al/q-1 SBLSYFIUPXRQRY-UHFFFAOYSA-N [Al-] Al-  
7429905 Al Aluminum atom InChI=1S/Al XAGFODPZIPBFFR-UHFFFAOYSA-N [Al] Al   Alaun; Aluminium; Aluminum; Aluminum 27
7429905 Al+ Aluminum atom cation InChI=1S/Al/q+1 KVLCHQHEQROXGN-UHFFFAOYSA-N [Al+] Al+  
13967221 AlH- aluminum monohydride anion InChI=1S/Al.H/q-1; GPPJFULYRSNYHE-UHFFFAOYSA-N [AlH-]  
13967221 AlH aluminum monohydride InChI=1S/Al.H SPRIOUNJHPCKPV-UHFFFAOYSA-N [AlH]   Aluminum hydride
13967221 AlH+ aluminum monohydride cation InChI=1S/Al.H/q+1; BSDSLUUQUQGTMP-UHFFFAOYSA-N [AlH+]  
13967221 AlH+ aluminum monohydride cation InChI=1/Al.H/q+1;/rAlH/h1H/q+1 BSDSLUUQUQGTMP-SDLXDVTNNA-N [AlH+]  
14457659 AlH2- aluminum dihydride anion InChI=1S/Al.2H/q-1;; QCBHFZBUEQBFNL-UHFFFAOYSA-N [AlH2-]  
14457659 AlH2- aluminum dihydride anion InChI=1/Al.2H/q-1;;/rAlH2/h1H2/q-1 QCBHFZBUEQBFNL-VTESIKLQNA-N [AlH2-]  
14457659 AlH2 aluminum dihydride InChI=1S/Al.2H AYENPGKIIRJZBT-UHFFFAOYSA-N [AlH2]  
14457659 AlH2+ aluminum dihydride cation InChI=1S/Al.2H/q+1;; GOQFGEHFZBDYEC-UHFFFAOYSA-N [AlH2+]  
14457659 AlH2+ aluminum dihydride cation InChI=1/Al.2H/q+1;;/rAlH2/h1H2/q+1 GOQFGEHFZBDYEC-URGSOASMNA-N [AlH2+]  
7784216 AlH3- aluminum trihydride anion InChI=1S/Al.3H/q-1;;; VCQUXTJZTDLELV-UHFFFAOYSA-N [AlH3-]  
7784216 AlH3- aluminum trihydride anion InChI=1/Al.3H/q-1;;;/rAlH3/h1H3/q-1 VCQUXTJZTDLELV-ACNMIOQWNA-N [AlH3-]  
7784216 AlH3- aluminum trihydride anion InChI=1S/Al.3H/q-1;;; VCQUXTJZTDLELV-UHFFFAOYSA-N [AlH3-]  
7784216 AlH3 aluminum trihydride InChI=1S/Al.3H AZDRQVAHHNSJOQ-UHFFFAOYSA-N [AlH3]   α-Aluminum trihydride; Alane; Aluminum hydride; Aluminum hydride (AlH3); Aluminum trihydride; UN 2463; alpha-Aluminum trihydride
7784216 AlH3 aluminum trihydride InChI=1/Al.3H/rAlH3/h1H3 AZDRQVAHHNSJOQ-FSBNLZEDNA-N [AlH3]   α-Aluminum trihydride; Alane; Aluminum hydride; Aluminum hydride (AlH3); Aluminum trihydride; UN 2463; alpha-Aluminum trihydride
7784216 AlH3+ aluminum trihydride cation InChI=1S/Al.3H/q+1;;; UGETZQQDAYQULB-UHFFFAOYSA-N [AlH3+]  
7784216 AlH3+ aluminum trihydride cation InChI=1S/Al.3H/q+1;;; UGETZQQDAYQULB-UHFFFAOYSA-N [AlH3+]  
19469819 AlH4- Aluminum tetrahydride anion InChI=1S/Al.4H/q-1;;;; WVZWSVHLGBNEIG-UHFFFAOYSA-N [Al-].[H].[H].[H].[H]  
7440213 Si- Silicon atom anion InChI=1S/Si/q-1 HJELPJZFDFLHEY-UHFFFAOYSA-N [Si-] Si-  
7440213 Si Silicon atom InChI=1S/Si XUIMIQQOPSSXEZ-UHFFFAOYSA-N [Si] Si   Defoamer S-10; Silicon; UN 1346
7440213 Si+ Silicon atom cation InChI=1S/Si/q+1 FSLGCYNKXXIWGJ-UHFFFAOYSA-N [Si+] Si+  
13774942 SiH- silicon monohydride anion InChI=1S/HSi/h1H/q-1 YENZRLHDDWKZRA-UHFFFAOYSA-N [SiH-]  
13774942 SiH Silylidyne InChI=1S/HSi/h1H QHGSGZLLHBKSAH-UHFFFAOYSA-N [SiH]   Silicon hydride; Silylidyne
13774942 SiH+ silicon monohydride cation InChI=1S/HSi/h1H/q+1 DNOWURJULUQXJY-UHFFFAOYSA-N [SiH+]  
13825906 SiH2- silicon dihydride anion InChI=1S/H2Si/h1H2/q-1 TXDGZDQGYYLGTJ-UHFFFAOYSA-N [SiH2-]  
13825906 SiH2 silicon dihydride InChI=1S/H2Si/h1H2 XMIJDTGORVPYLW-UHFFFAOYSA-N [SiH2]   Silylene; Silylene radical
13825906 SiH2+ silicon dihydride cation InChI=1S/H2Si/h1H2/q+1 SYWMLUYLILUMRO-UHFFFAOYSA-N [SiH2+]  
13765441 SiH3- Silyl anion InChI=1S/H3Si/h1H3/q-1 LNVJLOIIRUIQCP-UHFFFAOYSA-N [SiH3-]  
13765441 SiH3 Silyl radical InChI=1S/H3Si/h1H3 OLRJXMHANKMLTD-UHFFFAOYSA-N [SiH3]   Silyl radical; silyl
13765441 SiH3+ Silyl cation InChI=1S/H3Si/h1H3/q+1 SCABQASLNUQUKD-UHFFFAOYSA-N [SiH3+]  
7803625 SiH4 Silane InChI=1S/H4Si/h1H4 BLRPTPMANUNPDV-UHFFFAOYSA-N [SiH4]   Monosilane; Silane; Silicane; Silicon hydride; Silicon hydride (SiH4); Silicon tetrahydride; UN 2203
7803625 SiH4+ Silane cation InChI=1S/H4Si/h1H4/q+1 WHUUBEIUVZVOTM-UHFFFAOYSA-N [SiH4+]  
7723140 P- Phosphorus atom anion InChI=1S/P/q-1 FFZANLXOAFSSGC-UHFFFAOYSA-N [P-] P-  
7723140 P Phosphorus atom InChI=1S/P OAICVXFJPJFONN-UHFFFAOYSA-N [P] P   Phosphorous; Phosphorus; Phosphorus, red; Phosphorus-30; Red phosphorus; White phosphorus; UN 1338
7723140 P+ Phosphorus atom cation InChI=1S/P/q+1 FTFMSLKBXSATDG-UHFFFAOYSA-N [P+] P+  
13967141 PH- phosphorus monohydride anion InChI=1S/HP/h1H/q-1 VRUBMEWWHJUCBX-UHFFFAOYSA-N [PH-]  
13967141 PH phosphorus monohydride InChI=1S/HP/h1H BHEPBYXIRTUNPN-UHFFFAOYSA-N [PH]   Phosphinidene
13967141 PH+ phosphorus monohydride cation InChI=1S/HP/h1H/q+1 OVTNABWEZDTKEN-UHFFFAOYSA-N [PH+]  
13765430 PH2- Phosphino anion InChI=1S/H2P/h1H2/q-1 JZWFHNVJSWEXLH-UHFFFAOYSA-N [PH2-]  
13765430 PH2 Phosphino radical InChI=1S/H2P/h1H2 FVZVCSNXTFCBQU-UHFFFAOYSA-N [PH2]   Phosphino; Phosphino radical
13765430 PH2+ Phosphino cation InChI=1S/H2P/h1H2/q+1 UCEAQYMTODNVSU-UHFFFAOYSA-N [PH2+]  
7803512 PH3 Phosphine InChI=1S/H3P/h1H3 XYFCBTPGUUZFHI-UHFFFAOYSA-N P   Celphos; Delicia; Detia; Detia gas ex-B; Fosforowodor; Gas-ex-B; Hydrogen phosphide; Phosphene; Phosphine; Phosphorus hydride; Phosphorus trihydride; Phosphorwasserstoff; Rcra waste number P096; UN 2199; phosphane
7803512 PH3+ Phosphine cation InChI=1S/H3P/h1H3/q+1 UTXZMINRCDLQKG-UHFFFAOYSA-N [PH3+]  
9000195 PH4+ phosphonium cation InChI=1S/H3P/h1H3/p+1 XYFCBTPGUUZFHI-UHFFFAOYSA-O [PH4+]   Phosphine, protonated; phosphonium; phosphanium
7704349 S- Sulfur atom anion InChI=1S/S/q-1 ARNUDCKQSCEIEX-UHFFFAOYSA-N [S-] S-  
7704349 S Sulfur atom InChI=1S/S NINIDFKCEFEMDL-UHFFFAOYSA-N [S] S   Asulfa-Supra; Atomic sulfur; Bensulfoid; Brimstone; Colloidal sulfur; Colloidal-S; Colsul; component of Bensulfoid; Corosul D and S; Cosan; Cosan 80; Crystex; Elosal; Flour sulfur; Flowers of sulfur; Flowers of sulphur; Ground vocle sulfur; Hexasul; Kolloidschwefel 95; Kolo 100; Kolofog; Kolospray; Kumulus; Magnetic 70, 90, and 95; Micowetsulf; Microflotox; Netzschwefel; Polsulkol Extra; Precipitated sulfur; RC-Schwefel Extra; Sofril; Sperlox-S; Spersul; Spersul thiovit; Sublimed sulfur; Sufran; Sufran D; Sulfex; Sulfidal; Sulforon; Sulfur; Sulfur atom; Sulfur Soap; Sulfur, Precipitated; Sulikol; Sulkol; Sulsol; Sultaf; Super cosan; Svovl; Thiolux; Thiovit; Ultra Sulfur
7704349 S+ Sulfur atom cation InChI=1S/S/q+1 NKARKLBRYYSBBM-UHFFFAOYSA-N [S+] S+  
13940211 SH- mercapto anion InChI=1S/H2S/h1H2/p-1 RWSOTUBLDIXVET-UHFFFAOYSA-M [SH-]   HS anion; hydrogensulfide
13940211 SH Mercapto radical InChI=1S/HS/h1H PXQLVRUNWNTZOS-UHFFFAOYSA-N [SH]   Mercapto; Mercapto radical
13940211 SH+ sulfur monohydride cation InChI=1S/HS/h1H/q+1 GSVBMMRCPHEJKN-UHFFFAOYSA-N [SH+]  
13780239 DS Mercapto-d InChI=1S/HS/h1H/i1D PXQLVRUNWNTZOS-MICDWDOJSA-N [S][2H]   Mercapto-D
13536942 D2S Hydrogen sulfide-d2 InChI=1S/H2S/h1H2/i/hD2 RWSOTUBLDIXVET-ZSJDYOACSA-N S([2H])[2H]   Hydrogen sulfide-D2
7783064 H2S- Hydrogen sulfide anion InChI=1S/H2S/h1H2/q-1 ORXYGCWTUSCTLH-UHFFFAOYSA-N [SH2-]  
7783064 H2S- Hydrogen sulfide anion InChI=1S/H2S/h1H2/q-1 ORXYGCWTUSCTLH-UHFFFAOYSA-N [SH2-]  
7783064 H2S Hydrogen sulfide InChI=1S/H2S/h1H2 RWSOTUBLDIXVET-UHFFFAOYSA-N S   Acide sulfhydrique; Dihydrogen monosulfide; Dihydrogen sulfide; Hepatic gas; Hydrogen sulfide; Hydrogen sulfide (H2S); Hydrogen sulfuric acid; Hydrogene sulfure; Hydrogen-sulphide-; Hydrosulfuric acid; Idrogeno solforato; Rcra waste number U135; Schwefelwasserstoff; Siarkowodor; Stink damp; Sulfur hydride; Sulfureted hydrogen; Sulfuretted hydrogen; UN 1053; Zwavelwaterstof; Sulfane
7783064 H2S+ Hydrogen sulfide cation InChI=1S/H2S/h1H2/q+1 PZLIRJTVVIBARZ-UHFFFAOYSA-N [SH2+]  
18155210 H3S+ Sulfonium cation InChI=1S/H2S/h1H2/p+1 RWSOTUBLDIXVET-UHFFFAOYSA-O [SH3+]   Sulfonium
22537151 Cl- Chlorine atom anion InChI=1S/ClH/h1H/p-1 VEXZGXHMUGYJMC-UHFFFAOYSA-M [Cl-] Cl-  
22537151 Cl Chlorine atom InChI=1S/Cl ZAMOUSCENKQFHK-UHFFFAOYSA-N [Cl] Cl   Chlorine atom; Chlorine radical; chlorine
22537151 Cl+ Chlorine atom cation InChI=1S/Cl/q+1 KVPIFZRDXDYGBA-UHFFFAOYSA-N [Cl+] Cl+  
7698057 DCl Hydrochloric acid-d InChI=1S/ClH/h1H/i/hD VEXZGXHMUGYJMC-DYCDLGHISA-N [2HCl]   Hydrochloric acid-d
7647010 HCl- hydrogen chloride anion InChI=1S/ClH/h1H/q-1 XTUZKALZYULBAJ-UHFFFAOYSA-N [ClH-]  
7647010 HCl Hydrogen chloride InChI=1S/ClH/h1H VEXZGXHMUGYJMC-UHFFFAOYSA-N Cl   Acide chlorhydrique; Acido cloridrico; Anhydrous hydrochloric acid; Anhydrous hydrogen chloride; Basilin; Chloorwaterstof; Chlorohydric acid; Chlorowodor; Chlorwasserstoff; Dilute hydrochloric acid; Hydrochloric Acid; Hydrochloric acid gas; Hydrochloric acid mixture; Hydrochloric acid, anhydrous; Hydrochloride; Hydrogen chloride; Hydrogen-chloride-anhydrous-; Muriatic acid; NA 1789; Salzsaeure; Spirits of salt; UN 1050; UN 1789; UN 2186
7647010 HCl+ hydrogen chloride cation InChI=1S/ClH/h1H/q+1 BMELVZUCMXKZLN-UHFFFAOYSA-N [ClH+]  
42348414 H2Cl+ dihydrogen monochloride cation InChI=1S/ClH2/h1H2/q+1 IGJWHVUMEJASKV-UHFFFAOYSA-N [ClH2+]   chloronium
7440371 Ar- Argon atom anion InChI=1S/Ar/q-1 WVEDPOPMYOEMCB-UHFFFAOYSA-N [Ar-] Ar-  
7440371 Ar Argon atom InChI=1S/Ar XKRFYHLGVUSROY-UHFFFAOYSA-N [Ar] Ar   UN 1006; UN 1951; Argon
7440371 Ar+ Argon atom cation InChI=1S/Ar/q+1 XJVBHCCEUWWHMI-UHFFFAOYSA-N [Ar+] Ar+  
12254681 ArH+ Argon hydride cation InChI=1S/ArH/h1H/q+1 TVQSUVFYDVJWLI-UHFFFAOYSA-N [ArH+]  
7440097 K- Potassium atom anion InChI=1S/K/q-1 UWWOIRWVTCLRBA-UHFFFAOYSA-N [K-] K-  
7440097 K Potassium atom InChI=1S/K ZLMJMSJWJFRBEC-UHFFFAOYSA-N [K] K   UN 1420; UN 2257
7440097 K+ Potassium atom cation InChI=1S/K/q+1 NPYPAHLBTDXSSS-UHFFFAOYSA-N [K+] K+  
7693267 KH Potassium hydride InChI=1S/K.H NTTOTNSKUYCDAV-UHFFFAOYSA-N [KH]  
7693267 KH+ Potassium hydrogen cation InChI=1S/K.H/q+1; IVAWLQKTSHESMG-UHFFFAOYSA-N [KH+]  
7440702 Ca- Calcium atom anion InChI=1S/Ca/q-1 XKKBEAHLYVJDCI-UHFFFAOYSA-N [Ca-] Ca-  
7440702 Ca Calcium atom InChI=1S/Ca OYPRJOBELJOOCE-UHFFFAOYSA-N [Ca] Ca  
7440702 Ca+ Calcium atom cation InChI=1S/Ca/q+1 JDMNMMCDWTVNSP-UHFFFAOYSA-N [Ca+] Ca+  
14452756 CaH Calcium monohydride InChI=1S/Ca.H PKHCKQOIOXDRJH-UHFFFAOYSA-N [CaH]  
14452756 CaH+ Calcium monohydride cation InChI=1S/Ca.H/q+1; RCNSIXLSPLIYSS-UHFFFAOYSA-N [CaH+]  
7789788 CaH2 Calcium Hydride InChI=1S/Ca.2H FAQLAUHZSGTTLN-UHFFFAOYSA-N [CaH2]   Calcium dihydride; calcium hydride
7789788 CaH2 Calcium Hydride InChI=1S/Ca.2H FAQLAUHZSGTTLN-UHFFFAOYSA-N [CaH2]   Calcium dihydride; calcium hydride
7440202 Sc Scandium atom InChI=1S/Sc SIXSYDAISGFNSX-UHFFFAOYSA-N [Sc] Sc  
7440202 Sc+ Scandium cation InChI=1S/Sc/q+1 MHBCCBGBYYHDBC-UHFFFAOYSA-N [Sc+] Sc+  
33486021 ScH Scandium monohydride InChI=1S/Sc.H ZTOCXCPDHKWLBM-UHFFFAOYSA-N [ScH]  
33486021 ScH+ Scandium monohydride cation InChI=1S/Sc.H/q+1; [ScH+]  
43238079 ScH3 Scandium trihydride InChI=1S/Sc.3H NTLPNEDDYLQQDI-UHFFFAOYSA-N [ScH3]   Scandium hydride
43238079 ScH3 Scandium trihydride InChI=1S/Sc.3H NTLPNEDDYLQQDI-UHFFFAOYSA-N [ScH3]   Scandium hydride
13776993 TiH Titanium monohydride InChI=1S/Ti.H FUMHXHODRLFENL-UHFFFAOYSA-N [TiH]  
7440326 Ti- Titanium atom anion InChI=1S/Ti/q-1 GYWHMGQAAYKUQS-UHFFFAOYSA-N [Ti-] Ti-  
7440326 Ti Titanium atom InChI=1S/Ti RTAQQCXQSZGOHL-UHFFFAOYSA-N [Ti] Ti  
7440326 Ti+ Titanium atom cation InChI=1S/Ti/q+1 NWCHXEGXZIUQJS-UHFFFAOYSA-N [Ti+] Ti+  
7440622 V Vanadium atom InChI=1S/V LEONUFNNVUYDNQ-UHFFFAOYSA-N [V] V  
7439896 Fe Iron atom InChI=1S/Fe XEEYBQQBJWHFJM-UHFFFAOYSA-N [Fe] Fe  
7440508 Cu- Copper atom anion InChI=1S/Cu/q-1 RKADKOKIYLNVPJ-UHFFFAOYSA-N [Cu-] Cu-  
7440508 Cu Copper atom InChI=1S/Cu RYGMFSIKBFXOCR-UHFFFAOYSA-N [Cu] Cu  
7440508 Cu+ Copper atom cation InChI=1S/Cu/q+1 VMQMZMRVKUZKQL-UHFFFAOYSA-N [Cu+] Cu+  
13517005 CuH Copper monohydride InChI=1S/Cu.H JJFLDSOAQUJVBF-UHFFFAOYSA-N [CuH]  
7440666 Zn- Zinc atom anion InChI=1S/Zn/q-1 UFLZNUWLGDSEQA-UHFFFAOYSA-N [Zn-] Zn-  
7440666 Zn Zinc atom InChI=1S/Zn HCHKCACWOHOZIP-UHFFFAOYSA-N [Zn] Zn  
7440666 Zn+ Zinc atom cation InChI=1S/Zn/q+1 PLSXAKJQEDOMBH-UHFFFAOYSA-N [Zn+] Zn+  
13981878 ZnH Zinc monohydride InChI=1S/Zn.H FLVYKYVLYPYTAY-UHFFFAOYSA-N [ZnH]  
14018827 ZnH2 Zinc hydride InChI=1S/Zn.2H ZULTYUIALNTCSA-UHFFFAOYSA-N [ZnH2]  
14018827 ZnH2 Zinc hydride InChI=1S/Zn.2H ZULTYUIALNTCSA-UHFFFAOYSA-N [ZnH2]  
7440553 Ga- Gallium atom anion InChI=1S/Ga/q-1 CWZISXLENQJSCT-UHFFFAOYSA-N [Ga-] Ga-  
7440553 Ga Gallium atom InChI=1S/Ga GYHNNYVSQQEPJS-UHFFFAOYSA-N [Ga] Ga  
7440553 Ga+ Gallium atom cation InChI=1S/Ga/q+1 IFQPNYVMPDHHHH-UHFFFAOYSA-N [Ga+] Ga+  
13572924 GaH Gallium monohydride InChI=1S/Ga.H XBIFJPLECUHRFG-UHFFFAOYSA-N [GaH]  
13572924 GaH+ Gallium monohydride cation InChI=1S/Ga.H/q+1; [GaH+]  
13572935 GaH3 Gallium trihydride InChI=1S/Ga.3H PHMDYZQXPPOZDG-UHFFFAOYSA-N [GaH3]  
7440564 Ge- Germanium anion InChI=1S/Ge/q-1 HAIDGNUGORKGFS-UHFFFAOYSA-N [Ge-] Ge-  
7440564 Ge Germanium atom InChI=1S/Ge GNPVGFCGXDBREM-UHFFFAOYSA-N [Ge] Ge  
7440564 Ge+ Germanium cation InChI=1S/Ge/q+1 GJURCGDBQJCAEQ-UHFFFAOYSA-N [Ge+] Ge+  
13572991 GeH germylidene InChI=1S/GeH/h1H ROUHNNRKLNITEM-UHFFFAOYSA-N [GeH]  
13572991 GeH+ Germaniun monohyrdide cation InChI=1S/GeH/h1H/q+1 [GeH+]  
24968556 GeH2- germylene anion InChI=1S/GeH2/h1H2/q-1 JAQAYQUCMJAWLC-UHFFFAOYSA-N [GeH2-]  
24968556 GeH2 germylene InChI=1S/GeH2/h1H2 MWRNXFLKMVJUFL-UHFFFAOYSA-N [GeH2]  
13765452 GeH3 Germyl radical InChI=1S/GeH3/h1H3 WHYHZFHCWGGCOP-UHFFFAOYSA-N [GeH3]  
13765452 GeH3+ germyl cation InChI=1S/GeH3/h1H3/q+1 VBLCRKLUGXNPLU-UHFFFAOYSA-N [GeH3+]  
7782652 GeH4 Germane InChI=1S/GeH4/h1H4 QUZPNFFHZPRKJD-UHFFFAOYSA-N [GeH4]  
7440382 As- Arsenic anion InChI=1S/As/q-1 SAYILIZETGBEGT-UHFFFAOYSA-N [As-] As-  
7440382 As Arsenic atomic InChI=1S/As RQNWIZPPADIBDY-UHFFFAOYSA-N [As] As   Arsen
7440382 As+ Arsenic cation InChI=1S/As/q+1 QJMDPKWWZYVKPP-UHFFFAOYSA-N [As+] As+  
12628089 AsH Arsenic monohydride InChI=1S/AsH/h1H UIESIEAPEWREMY-UHFFFAOYSA-N [AsH]  
12628089 AsH+ Arsenic monohydride cation InChI=1S/AsH/h1H/q+1 YNRJCPSAOKLVNQ-UHFFFAOYSA-N [AsH+]  
14644452 AsH2 Arsenic dihydride InChI=1S/AsH2/h1H2 WLQSSCFYCXIQDZ-UHFFFAOYSA-N [AsH2]  
14644452 AsH2+ Arsenic dihydride cation InChI=1S/AsH2/h1H2/q+1 SVZSKDKRFCIVHU-UHFFFAOYSA-N [AsH2+]  
7784421 AsH3 Arsine InChI=1S/AsH3/h1H3 RBFQJDQYXXHULB-UHFFFAOYSA-N [AsH3]   Arsenic trihydride; Arsenic hydride; Arsenous hydride; Hydrogen arsenide; UN 2188; arsine
7784421 AsH3+ Arsine cation InChI=1S/AsH3/h1H3/q+1 LTKWZIUEGOOERX-UHFFFAOYSA-N [AsH3+]  
7782492 Se- Selenium atom anion InChI=1S/Se/q-1 SUHKCRJAAHZROE-UHFFFAOYSA-N [Se-] Se-  
7782492 Se Selenium atom InChI=1S/Se BUGBHKTXTAQXES-UHFFFAOYSA-N [Se] Se   Selenium
7782492 Se+ Selenium atom cation InChI=1S/Se/q+1 XEBNFCTZPFEGJZ-UHFFFAOYSA-N [Se+] Se+  
13940222 HSe- selenium monohydride anion InChI=1S/H2Se/h1H2/p-1 SPVXKVOXSXTJOY-UHFFFAOYSA-M [SeH-]  
13940222 HSe Selenium monohydride InChI=1S/HSe/h1H VUGWMQXJZSOYNI-UHFFFAOYSA-N [SeH]  
13940222 HSe+ selenium monohydride cation InChI=1S/HSe/h1H/q+1 LVYQWKJDVCSMKZ-UHFFFAOYSA-N [SeH+]  
7783075 H2Se Hydrogen selenide InChI=1S/H2Se/h1H2 SPVXKVOXSXTJOY-UHFFFAOYSA-N [SeH2]  
7783075 H2Se+ Hydrogen selenide cation InChI=1S/H2Se/h1H2/q+1 OYCCEJDXRNNGFC-UHFFFAOYSA-N [SeH2+]  
42423187 H3Se+ Hydrogen Selenide, protonated InChI=1S/H2Se/h1H2/p+1 [SeH3+]   Selenonium
10097322 Br- Bromine atom anion InChI=1S/BrH/h1H/p-1 CPELXLSAUQHCOX-UHFFFAOYSA-M [Br-] Br-  
10097322 Br Bromine atom InChI=1S/Br WKBOTKDWSSQWDR-UHFFFAOYSA-N [Br] Br   bromine; bromine
10097322 Br+ Bromine atom cation InChI=1S/Br/q+1 SOUPRKFYMHZDHZ-UHFFFAOYSA-N [Br+] Br+  
10035106 HBr- hydrogen bromide anion InChI=1S/BrH/h1H/q-1 VNDNKBDGWXYLAJ-UHFFFAOYSA-N [BrH-]  
10035106 HBr hydrogen bromide InChI=1S/BrH/h1H CPELXLSAUQHCOX-UHFFFAOYSA-N Br   Bromwasserstoff; Hydrobromic acid; hydrogen bromide
10035106 HBr+ hydrogen bromide cation InChI=1S/BrH/h1H CPELXLSAUQHCOX-UHFFFAOYSA-N [BrH+]  
36658545 H2Br+ protonated hydrogen bromide InChI=1S/BrH2/h1H2/q+1 [BrH2+]  
7439909 Kr Krypton atom InChI=1S/Kr DNNSSWSSYDEUBZ-UHFFFAOYSA-N [Kr] Kr   Krypton
14362448 I- Iodine atom anion InChI=1S/HI/h1H/p-1 XMBWDFGMSWQBCA-UHFFFAOYSA-M [I-] I-  
14362448 I Iodine atom InChI=1S/I ZCYVEMRRCGMTRW-UHFFFAOYSA-N [I] I  
14362448 I+ Iodine atom cation InChI=1S/I/q+1 OCVXZQOKBHXGRU-UHFFFAOYSA-N [I+] I+  
10034852 HI Hydrogen iodide InChI=1S/HI/h1H XMBWDFGMSWQBCA-UHFFFAOYSA-N I   Hydriodic acid; Hydroiodic acid; hydrogen iodide
14452596 Li2- lithium dimer anion InChI=1S/2Li/q;-1 DCXJJSWYYIPAAD-UHFFFAOYSA-N [Li]=[Li-]  
14452596 Li2 Lithium diatomic InChI=1S/2Li SMBQBQBNOXIFSF-UHFFFAOYSA-N [Li][Li]   Lithium; Lithium dimer; dilithium
14452596 Li2+ lithium diatomic cation InChI=1S/2Li/q;+1 MUROIUMQESCVOM-UHFFFAOYSA-N [Li][Li+]  
14452609 Be2- Beryllium dimer anion InChI=1S/2Be/q;-1 MPNVSFJMJLUABI-UHFFFAOYSA-N [Be-]#[Be]  
14452609 Be2 Beryllium diatomic InChI=1S/2Be SQOQGLGTQLQRCC-UHFFFAOYSA-N [Be][Be]   Beryllium; diberyllium
14452609 Be2+ Beryllium diatomic cation InChI=1S/2Be/q;+1 OHDADTLFLQMTIK-UHFFFAOYSA-N [Be+][Be]  
9000365 LiBe Lithium Beryllium InChI=1S/Be.Li OXCFQWSYBCETRX-UHFFFAOYSA-N [Li][Be]  
14452610 B2- Boron diatomic anion InChI=1S/B2/c1-2/q-1 PZMBRWKYOAZOLI-UHFFFAOYSA-N [B-]#B  
14452610 B2 Boron diatomic InChI=1S/B2/c1-2 ZOCHARZZJNPSEU-UHFFFAOYSA-N [B]=[B]   boron; boron dimer; diboron
14452610 B2+ Boron diatomic cation InChI=1S/B2/c1-2/q+1 NWEAICZXKBZCHB-UHFFFAOYSA-N [B+]=[B]  
12523567 LiB Lithium boride InChI=1S/B.Li PPTSBERGOGHCHC-UHFFFAOYSA-N [Li][B]   Lithium monoboride
57679637 BeB Beryllium monoboride InChI=1S/B.Be IIAHSYIVJGROSB-UHFFFAOYSA-N [Be][B]   Beryllium boride
18099451 B2H4 Diborane(4) D2d InChI=1S/B2H4/c1-2/h1-2H2 QSJRRLWJRLPVID-UHFFFAOYSA-N BB  
16949158 LiBH4 Lithium borohydride InChI=1S/BH4.Li/h1H4;/q-1;+1 UUKMSDRCXNLYOO-UHFFFAOYSA-N [Li+].[BH4-]   lithium tetrahydroborate
9000348 HBHHBH Diborane(4) C2V InChI=1S/B2H4/c1-3-2-4-1/h1-2H DMJZZSLVPSMWCS-UHFFFAOYSA-N  
19287457 B2H6 Diborane InChI=1S/B2H6/c1-3-2-4-1/h1-2H2 KLDBIFITUCWVCC-UHFFFAOYSA-N   Boron hydride; Diboron hexahydride; Boroethane; UN 1911
12011540 BC- boron monocarbide anion InChI=1S/CB/c1-2/q-1 PTCGYRYBWREJNW-UHFFFAOYSA-N B#[C-]   Boron carbide
12011540 BC boron monocarbide InChI=1S/CB/c1-2 UPGPUHVYNXOPJN-UHFFFAOYSA-N B#[C]   Boron carbide
12011540 BC+ boron monocarbide cation InChI=1S/CB/c1-2/q+1 ONHLBSUXAJZTBR-UHFFFAOYSA-N B#[C+]   Boron carbide
12070154 C2- carbon diatomic anion InChI=1S/C2/c1-2/q-1 XHWLRFQJZNQFGO-UHFFFAOYSA-N [C-]=[C]  
12070154 C2 Carbon diatomic InChI=1S/C2/c1-2 LBVWYGNGGJURHQ-UHFFFAOYSA-N [C]#[C]   Carbon (C2); Carbon dimer; Dicarbon
12070154 C2+ carbon diatomic cation InChI=1S/C2/c1-2/q+1 ADIRGMFQWJHVBM-UHFFFAOYSA-N [C+]#[C]  
57788939 LiC Lithium Carbide InChI=1S/C.Li YZSKZXUDGLALTQ-UHFFFAOYSA-N [Li][C]  
57788940 BeC beryllium carbide triplet InChI=1S/C.Be XBJYWZKBHDUHGE-UHFFFAOYSA-N [Be][C]  
2122487 C2H- Ethynyl anion InChI=1S/C2H/c1-2/h1H/q-1 BLRXYTIIKIPJQL-UHFFFAOYSA-N [C-]#C  
2122487 C2H Ethynyl radical InChI=1S/C2H/c1-2/h1H XEHVFKKSDRMODV-UHFFFAOYSA-N [C]#C   Ethynyl; Ethynyl radical
2122487 C2H+ Ethynyl cation InChI=1S/C2H/c1-2/h1H/q+1 UAYUAPRVBCKABF-UHFFFAOYSA-N [C+]#C  
2122487 C2H+ Ethynyl cation InChI=1S/C2H/c1-2/h1H/q+1 UAYUAPRVBCKABF-UHFFFAOYSA-N [C+]#C  
2143693 CCH2 vinylidene InChI=1S/C2H2/c1-2/h1H2 SNVLJLYUUXKWOJ-UHFFFAOYSA-N [C]=C  
74862 C2H2 Acetylene InChI=1S/C2H2/c1-2/h1-2H HSFWRNGVRCDJHI-UHFFFAOYSA-N C#C   Acetylen; Acetylene; Ethine; Ethyne; Narcylen; Vinylene; UN 1001
74862 C2H2+ acetylene cation InChI=1S/C2H2/c1-2/h1-2H/q+1 GWUDYHMQOUXMQT-UHFFFAOYSA-N [CH]=[CH+]  
2669898 C2H3- vinyl anion InChI=1S/C2H3/c1-2/h1H,2H2/q-1 [CH-][CH2]  
2669898 C2H3 vinyl InChI=1S/C2H3/c1-2/h1H,2H2 ORGHESHFQPYLAO-UHFFFAOYSA-N [CH]=C   Vinyl; Vinyl radical
2669898 C2H3+ vinyl cation InChI=1S/C2H3/c1-2/h1H,2H2/q+1 QLLSNXSJBAXPLZ-UHFFFAOYSA-N [CH+]=C  
2669898 C2H3+ vinyl cation InChI=1S/C2H3/c1-2/h1H,2H2/q+1 QLLSNXSJBAXPLZ-UHFFFAOYSA-N [CH+]=C  
917544 CH3Li methyl lithium InChI=1S/CH3.Li/h1H3; DVSDBMFJEQPWNO-UHFFFAOYSA-N [Li]C  
56125758 CH2BH methyleneborane InChI=1S/CH3B/c1-2/h2H,1H2 C=B  
4218502 CH3CH methylmethylene InChI=1S/C2H4/c1-2/h1H,2H3 UUFQTNFCRMXOAE-UHFFFAOYSA-N [CH]C  
74851 C2H4- Ethylene anion InChI=1S/C2H4/c1-2/h1-2H2/q-1 BZBBQTIJNPYMER-UHFFFAOYSA-N [CH2][CH2-]  
74851 C2H4- Ethylene anion InChI=1S/C2H4/c1-2/h1-2H2/q-1 BZBBQTIJNPYMER-UHFFFAOYSA-N [CH2][CH2-]  
74851 C2H4 Ethylene InChI=1S/C2H4/c1-2/h1-2H2 VGGSQFUCUMXWEO-UHFFFAOYSA-N C=C   Acetene; Athylen; Bicarburretted hydrogen; Elayl; Ethene; Ethylene; Liquid ethyene; Olefiant gas; UN 1038; UN 1962
74851 C2H4+ Ethylene cation InChI=1S/C2H4/c1-2/h1-2H2/q+1 RHAJFDHSLMUKSD-UHFFFAOYSA-N [CH2][CH2+]  
74851 C2H4+ Ethylene cation InChI=1S/C2H4/c1-2/h1-2H2/q+1 RHAJFDHSLMUKSD-UHFFFAOYSA-N [CH2][CH2+]  
2025561 C2H5- Ethyl anion InChI=1S/C2H5/c1-2/h1H2,2H3/q-1 KMMMKPYXRLFMSO-UHFFFAOYSA-N C[CH2-]  
2025561 C2H5 Ethyl radical InChI=1S/C2H5/c1-2/h1H2,2H3 QUPDWYMUPZLYJZ-UHFFFAOYSA-N [CH2]C   Ethyl radical; ethyl
2025561 C2H5+ Ethyl cation InChI=1S/C2H5/c1-2-3-1/h1-2H2/q+1 YPFHUCDBTFBXTJ-UHFFFAOYSA-N [CH2+]C  
2025561 C2H5+ Ethyl cation InChI=1S/C2H5/c1-2-3-1/h1-2H2/q+1 YPFHUCDBTFBXTJ-UHFFFAOYSA-N [CH2+]C  
74840 C2H6 Ethane InChI=1S/C2H6/c1-2/h1-2H3 OTMSDBZUPAUEDD-UHFFFAOYSA-N CC   Bimethyl; Dimethyl; Ethane; Ethyl hydride; Methylmethane; UN 1035; UN 1961
74840 C2H6 Ethane InChI=1S/C2H6/c1-2/h1-2H3 OTMSDBZUPAUEDD-UHFFFAOYSA-N CC   Bimethyl; Dimethyl; Ethane; Ethyl hydride; Methylmethane; UN 1035; UN 1961
74840 C2H6+ ethane cation InChI=1S/C2H6/c1-2/h1-2H3/q+1 DDZSVZNUVGBGGU-UHFFFAOYSA-N C[CH3+]  
74840 C2H6+ ethane cation InChI=1S/C2H6/c1-2/h1-2H3/q+1 DDZSVZNUVGBGGU-UHFFFAOYSA-N C[CH3+]  
74840 C2H6+ ethane cation InChI=1S/C2H6/c1-2/h1-2H3/q+1 DDZSVZNUVGBGGU-UHFFFAOYSA-N C[CH3+]  
9000381 C2H7+ Ethane, protonated InChI=1S/C2H7/c1-3-2/h1-2H3/q+1 UQJIDEGGAKZKSY-UHFFFAOYSA-N   ethanium cation
9000381 C2H7+ Ethane, protonated InChI=1S/C2H7/c1-3-2/h1-2H3/q+1 UQJIDEGGAKZKSY-UHFFFAOYSA-N NULL   ethanium cation
10043115 BN- boron nitride anion InChI=1S/BN/c1-2/q-1 IWPZHCBXSKNBIX-UHFFFAOYSA-N [B]=[N-]  
10043115 BN boron nitride InChI=1S/BN/c1-2 PZNSFCLAULLKQX-UHFFFAOYSA-N B#N  
10043115 BN+ boron nitride cation InChI=1S/BN/c1-2/q+1 WWQSUNDBMCMSCM-UHFFFAOYSA-N [B+]=[N]  
32746319 LiN Lithium Nitride InChI=1S/Li.N GRQJZSJOACLQOV-UHFFFAOYSA-N [Li][N]  
32746319 LiN+ Lithium Nitride cation InChI=1S/Li.N/q+1; SQXACIWGXCWAJG-UHFFFAOYSA-N [Li+][N]  
37279111 BeN- Beryllium mononitride anion InChI=1S/Be.N/q;-1 DNELMSQECYMCRT-UHFFFAOYSA-N [Be]=[N-]  
37279111 BeN Beryllium mononitride InChI=1S/Be.N APEPCQZGRMUTTC-UHFFFAOYSA-N [Be]=[N]  
37279111 BeN+ Beryllium mononitride cation InChI=1S/Be.N/q+1; SDMZGJPWTZTLFF-UHFFFAOYSA-N [Be+][N]  
2074875 CN- cyanide anion InChI=1S/CN/c1-2/q-1 XFXPMWWXUTWYJX-UHFFFAOYSA-N [C-]#N   Cyanide
2074875 CN Cyano radical InChI=1S/CN/c1-2 JEVCWSUVFOYBFI-UHFFFAOYSA-N [C]#N   Cyano radical; Cyanogen
2074875 CN+ Cyano cation InChI=1S/CN/c1-2/q+1 NKCCODPFBDGPRJ-UHFFFAOYSA-N [C+]#N  
7727379 N2- nitrogen diatomic anion InChI=1S/N2/c1-2/q-1 WBONKFSJBYZDJN-UHFFFAOYSA-N [N-]=[N]  
7727379 N2 Nitrogen diatomic InChI=1S/N2/c1-2 IJGRMHOSHXDMSA-UHFFFAOYSA-N N#N   Diatomic nitrogen; Dinitrogen; Molecular nitrogen; Nitrogen; Nitrogen gas; Nitrogen-14; UN 1066; UN 1977
7727379 N2+ diatomic nitrogen cation InChI=1S/N2/c1-2/q+1 OCLMUTJUZGFVFC-UHFFFAOYSA-N [N+]#N  
6914074 HNC hydrogen isocyanide InChI=1S/CHN/c1-2/h2H QIUBLANJVAOHHY-UHFFFAOYSA-N [NH+]#[C-]   Isocyanic acid
74908 HCN- Hydrogen cyanide anion InChI=1S/CHN/c1-2/h1H/q-1 ATBDVLSINHAXGY-UHFFFAOYSA-N [CH-]=[N]  
74908 HCN Hydrogen cyanide InChI=1S/CHN/c1-2/h1H LELOWRISYMNNSU-UHFFFAOYSA-N C#N   AC; Acide cyanhydrique; Acido cianidrico; Aero liquid hcn; Aero@ Liquid HCN; Blausaeure; Blausaeure (German); Blauwzuur; Carbon hydride nitride; Carbon hydride nitride (CHN); Cyaanwaterstof; Cyanwasserstoff; Cyclon; Cyclone B; Cyjanowodor; Evercyn; Fluohydric acid gas; Formic anammonide; Formonitrile; Hydrocyanic acid; Hydrofluoric acid gas; Hydrogen cyanide; NA 1051; Prussic Acid; Prussic acid, unstabilized; Rcra waste number P063; Zaclondiscoids; UN 1051; UN 1613; UN 1614
74908 HCN+ hydrogen cyanide cation InChI=1S/CHN/c1-2/h1H/q+1 JUQAVPCSDMFGHW-UHFFFAOYSA-N [CH+][N]  
40493810 HNB hydrogen nitrogen boron InChI=1S/BHN/c1-2/h2H XIUTTYIRABRWRB-UHFFFAOYSA-N [NH][B]  
36882130 NNH Dinitrogen monohydride InChI=1S/HN2/c1-2/h1H NALBLJLOBICXRH-UHFFFAOYSA-N N=[N]  
36882130 NNH+ Dinitrogen monohydride cation InChI=1S/N2/c1-2/p+1 IJGRMHOSHXDMSA-UHFFFAOYSA-O [NH+]#N  
54980119 HCNH HCNH InChI=1S/CH2N/c1-2/h1-2H GNMFKYYLBRTFHL-UHFFFAOYSA-N [CH]=N  
54980119 HCNH HCNH InChI=1S/CH2N/c1-2/h1-2H GNMFKYYLBRTFHL-UHFFFAOYSA-N [CH]=N  
54980119 HCNH+ HCNH+ InChI=1S/CH2N/c1-2/h1-2H/q+1 DCMJLVFIGUTGGQ-UHFFFAOYSA-N [CH][NH+]  
15626423 N2H2 (Z)-Diazene InChI=1S/H2N2/c1-2/h1-2H/b2-1- RAABOESOVLLHRU-UPHRSURJSA-N N=N  
15626423 N2H2 (Z)-Diazene InChI=1S/H2N2/c1-2/h1-2H RAABOESOVLLHRU-UHFFFAOYSA-N  
15626434 N2H2 trans-diazine InChI=1S/H2N2/c1-2/h1-2H/b2-1+ RAABOESOVLLHRU-OWOJBTEDSA-N N=N   (E)-Diazene; E-diazine; t-diazine; diazine; diazene
9000286 H2CN H2CN InChI=1S/CH2N/c1-2/h1H2 PZIDJKOIMRBQLL-UHFFFAOYSA-N C=[N]   Amidogen, methylene-
9000286 H2CN+ hydrocyanonium cation InChI=1S/CH2N/c1-2/h1H2/q+1 MKPAEABOTWWIBE-UHFFFAOYSA-N [CH2+][N]   protonated hydrogen cyanide; hydrocyanonium
9000317 CNH2 CNH2 InChI=1S/CH2N/c1-2/h2H2 OGBYLFXCCAHRHC-UHFFFAOYSA-N [C]N  
9000317 CNH2+ CNH2+ InChI=1S/CH2N/c1-2/h2H2/q+1 RYMZMJIGPPIVIV-UHFFFAOYSA-N [C]=[NH2+]  
2053294 CH2NH Methanimine InChI=1S/CH3N/c1-2/h2H,1H2 WDWDWGRYHDPSDS-UHFFFAOYSA-N C=N   Methanimine; Methyleneimine
302012 N2H4 Hydrazine InChI=1S/H4N2/c1-2/h1-2H2 OAKJQQAXSVQMHS-UHFFFAOYSA-N NN   Diamide; Diamide hydrate; Diamine; Hydrazine; Hydrazine, anhydrous; Hydrazyna; Levoxine; Rcra waste number U133; UN 2030; UN 2029
302012 N2H4+ hydrazine cation InChI=1S/H4N2/c1-2/h1-2H2/q+1 HWDYJVUNTFRESF-UHFFFAOYSA-N [NH2+]N  
10507296 CH2NH2+ methyleneamine cation InChI=1S/CH4N/c1-2/h1-2H2/q+1 LEOYJZAFSUBIBE-UHFFFAOYSA-N [CH2+]N  
10507296 CH2NH2+ methyleneamine cation InChI=1S/CH3N/c1-2/h2H,1H2/p+1 WDWDWGRYHDPSDS-UHFFFAOYSA-O C=[NH2+]  
74895 CH3NH2 methyl amine InChI=1S/CH5N/c1-2/h2H2,1H3 BAVYZALUXZFZLV-UHFFFAOYSA-N CN   Aminomethane; Anhydrous methylamine; Carbinamine; Mercurialin; Methanamine; Methylamine; Methylaminen; Metilamine; Metyloamina; Monomethylamine; UN 1235; UN 1061
74895 CH3NH2+ methyl amine cation InChI=1S/CH5N/c1-2/h2H2,1H3/q+1 C[NH2+]  
22 NH3NH3 Ammonia Dimer InChI=1S/H6N2/c1-3-2/h1H2,2H3 AHBOEPYNTHNWIX-UHFFFAOYSA-N N.N  
22 NH3NH3 Ammonia Dimer InChI=1S/H6N2/c1-3-2/h1H2,2H3 AHBOEPYNTHNWIX-UHFFFAOYSA-N N.N  
13774817 BH3NH3 borane ammonia InChI=1S/BH6N/c1-2/h1-2H3 PJYXJGDRFASJSB-UHFFFAOYSA-N [BH3-][NH3+]  
17000009 CH3NH3 methyl ammonium radical InChI=1S/CH6N/c1-2/h1-2H3 LRGWETHRDQOAES-UHFFFAOYSA-N C[NH3]  
17000009 CH3NH3+ protonated methylamine InChI=1S/CH5N/c1-2/h2H2,1H3/p+1 BAVYZALUXZFZLV-UHFFFAOYSA-O C[NH3+]  
10102439 NO- nitric oxide anion InChI=1S/NO/c1-2/q-1 FZRKAZHKEDOPNN-UHFFFAOYSA-N [N-]=O  
10102439 NO Nitric oxide InChI=1S/NO/c1-2 MWUXSHHQAYIFBG-UHFFFAOYSA-N [N]=O   Amidogen, oxo-; Nitric oxide; Nitrogen monoxide; Nitrogen oxide; Nitrogen oxide (NO); Nitrosyl radical
10102439 NO+ nitric oxide cation InChI=1S/NO/c1-2/q+1 KEJOCWOXCDWNID-UHFFFAOYSA-N [O+]#N  
12142777 LiO- lithium oxide anion InChI=1S/Li.O/q;-1 IXZJKKSRIFXCQD-UHFFFAOYSA-N [Li][O-]  
12142777 LiO lithium oxide InChI=1S/Li.O QTJOIXXDCCFVFV-UHFFFAOYSA-N [Li][O]   Lithium oxide
12142777 LiO+ lithium oxide cation InChI=1S/Li.O/q+1; DTJNZKWRAPCRSU-UHFFFAOYSA-N [Li+]=O  
12505770 BO- boron monoxide anion InChI=1S/BO/c1-2/q-1 QDUNNVFNOBEOOX-UHFFFAOYSA-N [B][O-]  
12505770 BO boron monoxide InChI=1S/BO/c1-2 MOWNZPNSYMGTMD-UHFFFAOYSA-N [B]=O   Boron monoxide; Boron oxide
12505770 BO+ boron monoxide cation InChI=1S/BO/c1-2/q+1 OVSXTYPBDUJXGF-UHFFFAOYSA-N [B+]=O  
630080 CO- carbon monoxide anion InChI=1S/CO/c1-2/q-1 DCMZLVSOPGZIFI-UHFFFAOYSA-N [C][O-]  
630080 CO Carbon monoxide InChI=1S/CO/c1-2 UGFAIRIUMAVXCW-UHFFFAOYSA-N [C]=O   Carbon monooxide; Carbon monoxide; Carbon monoxide, cryogenic liquid; Carbon oxide; Carbon oxide (CO); Carbon oxide (CO1+); Carbone; Carbonic oxide; Carbonio; Exhaust Gas; Flue gas; Flue gasnide; Kohlenmonoxid; Kohlenoxyd; Koolmonoxyde; Monoxide; NA 9202; Oxyde de carbone; UN 1016; Wegla tlenek
630080 CO+ carbon monoxide cation InChI=1S/CO/c1-2/q+1 BOJPITGAFFYFJK-UHFFFAOYSA-N [C+]=O  
1304569 BeO- Beryllium monoxide anion InChI=1S/Be.O/q;-1 VGVBRKDKZFQTIU-UHFFFAOYSA-N [Be][O-]  
1304569 BeO beryllium oxide InChI=1S/Be.O LTPBRCUWZOMYOC-UHFFFAOYSA-N [Be]=O   BeO; Beryllia; Beryllium monoxide; Beryllium oxide; Beryllium oxide (BeO); Beryllium oxide, α; Thermalox
1304569 BeO+ Beryllium monoxide cation InChI=1S/Be.O/q;+1 JKPCLXOLRBTQAQ-UHFFFAOYSA-N [Be+][O]  
7782447 O2- oxygen diatomic anion InChI=1S/HO2/c1-2/h1H/p-1 OUUQCZGPVNCOIJ-UHFFFAOYSA-M [O-][O]  
7782447 O2 Oxygen diatomic InChI=1S/O2/c1-2 MYMOFIZGZYHOMD-UHFFFAOYSA-N O=O   Dioxygen; Molecular oxygen; Oxygen; Oxygen molecule; Oxygen-16; UN 1072; UN 1073
7782447 O2+ diatomic oxygen cation InChI=1S/O2/c1-2/q+1 KMHJKRGRIJONSV-UHFFFAOYSA-N [O+]=O  
1310663 LiOH lithium hydroxide InChI=1S/Li.H2O/h;1H2/q+1;/p-1 WMFOQBRAJBCJND-UHFFFAOYSA-M [Li]O   Lithium Hydroxide; Lithium hydroxide hydrate; Lithium hydroxide, monohydrate; UN 2680
3170830 HO2- Hydroperoxy anion InChI=1S/H2O2/c1-2/h1-2H/p-1 MHAJPDPJQMAIIY-UHFFFAOYSA-M O[O-]  
3170830 HO2 Hydroperoxy radical InChI=1S/HO2/c1-2/h1H OUUQCZGPVNCOIJ-UHFFFAOYSA-N O[O]   Hydroperoxo; Hydroperoxy radical; hydroperoxyl
3170830 HO2+ Hydroperoxy cation InChI=1S/O2/c1-2/p+1 MYMOFIZGZYHOMD-UHFFFAOYSA-O  
3170830 HO2+ Hydroperoxy cation InChI=1S/O2/c1-2/p+1 MYMOFIZGZYHOMD-UHFFFAOYSA-O NULL  
2597446 HCO- formyl anion InChI=1S/CHO/c1-2/h1H/q-1 CKJNUZNMWOVDFN-UHFFFAOYSA-N [CH-]=O  
2597446 HCO Formyl radical InChI=1S/CHO/c1-2/h1H CFHIDWOYWUOIHU-UHFFFAOYSA-N [CH]=O   Formyl; Formyl radical
2597446 HCO+ Formyl cation InChI=1S/CHO/c1-2/h1H/q+1 XPRMKTHGXOVKEH-UHFFFAOYSA-N [CH+]=O  
20611590 HBO Boron hydride oxide InChI=1S/BHO/c1-2/h1H UXUFOKFTFHRQTE-UHFFFAOYSA-N B=O   Boron hydride oxide; oxoborane
20768687 BeOH beryllium hydroxide InChI=1S/Be.H2O/h;1H2/q+1;/p-1 XTIMETPJOMYPHC-UHFFFAOYSA-M [Be]O   BeOH; Beryllium hydroxide
20768687 BeOH beryllium hydroxide InChI=1S/Be.H2O/h;1H2/q+1;/p-1 XTIMETPJOMYPHC-UHFFFAOYSA-M [Be]O   BeOH; Beryllium hydroxide
14332286 HNO- Nitrosyl hydride anion InChI=1S/HNO/c1-2/h1H/q-1 HSVWLSWXGPNANV-UHFFFAOYSA-N [NH-][O]  
14332286 HNO Nitrosyl hydride InChI=1S/HNO/c1-2/h1H ODUCDPQEXGNKDN-UHFFFAOYSA-N N=O   Nitrosyl hydride
14332286 HNO+ Nitrosyl hydride cation InChI=1S/HNO/c1-2/h1H/q+1 KFRCEISWMJUBLX-UHFFFAOYSA-N [NH+]=O  
19710566 HOCH hydroxycarbene InChI=1S/CH2O/c1-2/h1-2H UUOIGPDTLYBNGY-UHFFFAOYSA-N [CH]O  
19710566 HOCH hydroxycarbene InChI=1S/CH2O/c1-2/h1-2H UUOIGPDTLYBNGY-UHFFFAOYSA-N [CH]O  
13408292 H2NO nitroxide InChI=1S/H2NO/c1-2/h1H2 [NH2]=O  
7722841 H2O2 Hydrogen peroxide InChI=1S/H2O2/c1-2/h1-2H MHAJPDPJQMAIIY-UHFFFAOYSA-N OO   Dihydrogen dioxide; Elawox; Hydrogen dioxide; Hydrogen oxide; Hydrogen peroxide; Hydrogen peroxide (H2O2); Hydrogen Peroxide [Topical Solution]; Hydrogen peroxide solution; Perhydrol; Perossido di idrogeno; Peroxaan; Peroxyde d'hydrogene; Superoxol; T-Stuff; Waterstofperoxyde; UN 2014; Wasserstoffperoxid
7722841 H2O2 Hydrogen peroxide InChI=1S/H2O2/c1-2/h1-2H MHAJPDPJQMAIIY-UHFFFAOYSA-N OO   Dihydrogen dioxide; Elawox; Hydrogen dioxide; Hydrogen oxide; Hydrogen peroxide; Hydrogen peroxide (H2O2); Hydrogen Peroxide [Topical Solution]; Hydrogen peroxide solution; Perhydrol; Perossido di idrogeno; Peroxaan; Peroxyde d'hydrogene; Superoxol; T-Stuff; Waterstofperoxyde; UN 2014; Wasserstoffperoxid
7722841 H2O2+ Hydrogen peroxide cation InChI=1S/H2O2/c1-2/h1-2H/q+1 QLOMDXCKVWDSAC-UHFFFAOYSA-N O[OH+]  
7722841 H2O2+ Hydrogen peroxide cation InChI=1S/H2O2/c1-2/h1-2H/q+1 QLOMDXCKVWDSAC-UHFFFAOYSA-N O[OH+]  
50000 H2CO- formaldehyde anion InChI=1S/CH2O/c1-2/h1H2/q-1 RCQZCQSUQBQDGR-UHFFFAOYSA-N C=[O-]  
50000 H2CO Formaldehyde InChI=1S/CH2O/c1-2/h1H2 WSFSSNUMVMOOMR-UHFFFAOYSA-N C=O   Aldehyd mravenci; Aldehyde formique; Aldeide formica; BFV; FA; Fannoform; Formaldehyd; Formaldehyde; Formaldehyde, gas; Formalin; Formalin 40; Formalina; Formaline; Formalin-loesungen; Formalith; Formic aldehyde; Formol; Fyde; Hoch; Ivalon; Karsan; Lysoform; Methaldehyde; Methanal; Methyl aldehyde; Methylene glycol; Methylene oxide; Morbicid; NCI-C02799; Oplossingen; Oxomethane; Oxymethylene; Paraform; Polyoxymethylene glycols; Rcra waste number U122; Superlysoform; UN 2209; UN 1198
50000 H2CO+ formaldehyde cation InChI=1S/CH2O/c1-2/h1H2/q+1 SAJCHROCEMQFHF-UHFFFAOYSA-N C=[O+]  
9000359 H3O2+ hydrogen peroxide, protonated InChI=1S/H2O2/c1-2/h1-2H/p+1 MHAJPDPJQMAIIY-UHFFFAOYSA-O O[OH2+]  
9000359 H3O2+ hydrogen peroxide, protonated InChI=1/H2O2/c1-2/h1-2H/p+1/fH3O2/h1H/q+1 MHAJPDPJQMAIIY-CIJHYIHENA-O  
7803498 NH2OH hydroxylamine InChI=1S/H3NO/c1-2/h2H,1H2 AVXURJPOCDRRFD-UHFFFAOYSA-N NO   Oxammonium; hydroxylamine
2597435 CH2OH Hydroxymethyl radical InChI=1S/CH3O/c1-2/h2H,1H2 CBOIHMRHGLHBPB-UHFFFAOYSA-N [CH2]O   Hydroxymethyl; Hydroxymethyl radical; Methyl radical, hydroxy-; Methyl, hydroxy-
2597435 CH2OH+ hydroxymethyl cation InChI=1S/CH3O/c1-2/h2H,1H2/q+1 NRCYHMDIJIIHBJ-UHFFFAOYSA-N [CH2+]O  
2143682 CH3O- methoxy anion InChI=1S/CH3O/c1-2/h1H3/q-1 NBTOZLQBSIZIKS-UHFFFAOYSA-N C[O-]  
2143682 CH3O Methoxy radical InChI=1S/CH3O/c1-2/h1H3 GRVDJDISBSALJP-UHFFFAOYSA-N C[O]   Methoxy; Methoxy radical; methoxyl
2143682 CH3O+ Methoxy cation InChI=1S/CH3O/c1-2/h1H3/q+1 C[O+]  
38544488 NH3O Ammonia Oxide InChI=1S/H3NO/c1-2/h1H3 GSWAOPJLTADLTN-UHFFFAOYSA-N [NH3+][O-]   azane oxide
25655838 H2OH2O water dimer InChI=1S/H4O2/c1-3-2/h1H,2H2 CIFBQZMBEZYWOK-UHFFFAOYSA-N O.O   waterdimer
67561 CH3OH- Methyl alcohol anion InChI=1S/CH4O/c1-2/h2H,1H3/q-1 KRKKYJDHFWSRDI-UHFFFAOYSA-N C[OH-]  
67561 CH3OH- Methyl alcohol anion InChI=1/CH4O/c1-2/h2H,1H3/q-1 KRKKYJDHFWSRDI-UHFFFAOYNA-N C[OH-]  
67561 CH3OH- Methyl alcohol anion InChI=1S/CH4O/c1-2/h2H,1H3/q-1 KRKKYJDHFWSRDI-UHFFFAOYSA-N C[OH-]  
67561 CH3OH Methyl alcohol InChI=1S/CH4O/c1-2/h2H,1H3 OKKJLVBELUTLKV-UHFFFAOYSA-N CO   Alcool methylique; Alcool metilico; Carbinol; Colonial spirit; Columbian spirit; Columbian spirits; Hydroxymethane; Metanolo; Methanol; Methyl Alcohol; Methyl hydrate; Methyl hydroxide; Methylalkohol; Methylol; Metylowy alkohol; Monohydroxymethane; Pyroxylic spirit; Rcra waste number U154; Wood alcohol; UN 1230; Wood spirit; Wood naphtha
67561 CH3OH+ Methyl alcohol cation InChI=1S/CH4O/c1-2/h2H,1H3/q+1 GTZIRXXNRBNPPU-UHFFFAOYSA-N C[OH+]  
67561 CH3OH+ Methyl alcohol cation InChI=1/CH4O/c1-2/h2H,1H3/q+1 GTZIRXXNRBNPPU-UHFFFAOYNA-N C[OH+]  
67561 CH3OH+ Methyl alcohol cation InChI=1S/CH4O/c1-2/h2H,1H3/q+1 GTZIRXXNRBNPPU-UHFFFAOYSA-N C[OH+]  
33 H2ONH3 Water Ammonia Dimer InChI=1S/H5NO/c1-3-2/h2H,1H3 SPYQWCOYCDNQJZ-UHFFFAOYSA-N N.O  
9000371 CH3OH2+ Methanol, protonated InChI=1S/CH4O/c1-2/h2H,1H3/p+1 OKKJLVBELUTLKV-UHFFFAOYSA-O C[OH2+]  
12061700 FO- flourine oxide anion InChI=1S/FO/c1-2/q-1 VMUWIFNDNXXSQA-UHFFFAOYSA-N F[O-]  
12061700 FO Oxygen monofluoride InChI=1S/FO/c1-2 FXOFAYKVTOLJTJ-UHFFFAOYSA-N F[O]   Oxygen fluoride
12061700 FO+ fluorine monoxide cation InChI=1S/FO/c1-2/q+1 AYDJPXZJMHGWTB-UHFFFAOYSA-N F[O+]  
13768600 BF- Boron monofluoride anion InChI=1S/BF/c1-2/q-1 QXOGQXNQKDPDKB-UHFFFAOYSA-N [B][F-]  
13768600 BF Boron monofluoride InChI=1S/BF/c1-2 YFSQMOVEGCCDJL-UHFFFAOYSA-N [B]F   Fluoroborane
13768600 BF+ Boron monofluoride cation InChI=1S/BF/c1-2/q+1 FHUWYTSDAXHJFL-UHFFFAOYSA-N [B+]F  
13597961 BeF- Beryllium monofluoride anion InChI=1S/Be.FH/h;1H/p-1 HXWIRARPQGBRJQ-UHFFFAOYSA-M [Be][F-]  
13597961 BeF Beryllium monofluoride InChI=1S/Be.FH/h;1H/q+1;/p-1 ROPFUFXLORQKEY-UHFFFAOYSA-M [Be]F   Beryllium fluoride
13597961 BeF+ Beryllium monofluoride cation InChI=1S/Be.FH/h;1H/q+2;/p-1 VPZVBOPEQYBHOB-UHFFFAOYSA-M [Be+]F  
13967061 NF- nitrogen monofluorine anion InChI=1S/FN/c1-2/q-1 VVRUJRUIQRESLT-UHFFFAOYSA-N [N-]F   Fluoroimidogen anion
13967061 NF nitrogen fluoride InChI=1S/FN/c1-2 CMUBZTZNXGBJMQ-UHFFFAOYSA-N [N]F   Fluoroimidogen
13967061 NF+ nitrogen monofluoirde cation InChI=1S/FN/c1-2/q+1 NUTZSMVASAAMLV-UHFFFAOYSA-N [N+]F   Fluoroimidogen cation
3889756 CF- carbon monofluoride anion InChI=1S/CF/c1-2/q-1 DMDPHEHMMGEGQC-UHFFFAOYSA-N [C-]F  
3889756 CF Fluoromethylidyne InChI=1S/CF/c1-2 ISOSXCFSIDVNNC-UHFFFAOYSA-N [C]F   Fluoromethylidyne
3889756 CF+ carbon monofluoride cation InChI=1S/CF/c1-2/q+1 LDIFHDJQDDMHHQ-UHFFFAOYSA-N [C+]F  
7782414 F2- flourine diatomic anion InChI=1S/F2/c1-2/q-1 KVOOTFCSKAFKLT-UHFFFAOYSA-N [F-]F  
7782414 F2 Fluorine diatomic InChI=1S/F2/c1-2 PXGOKWXKJXAPGV-UHFFFAOYSA-N FF   Bifluoriden; Fluor; Fluorine; Fluorine, compressed; Fluoro; Fluorures acide; Fluoruri acidi; Rcra waste number P056; Saeure fluoride; UN 1045; difluorine
7782414 F2+ flourine diatomic cation InChI=1S/F2/c1-2/q+1 PCZTVBPMAMPCIP-UHFFFAOYSA-N [F+]F  
7789244 LiF- lithium fluoride anion InChI=1S/FH.Li/h1H;/p-1 MDGGAEUUFAWUTG-UHFFFAOYSA-M [Li][F-]  
7789244 LiF lithium fluoride InChI=1S/FH.Li/h1H;/q;+1/p-1 PQXKHYXIUOZZFA-UHFFFAOYSA-M [Li]F   Fluorolithium; Lithium fluoride; Lithium fluoride (Li3F3); Lithium fluoride (LiF); Lithium fluorure; Lithium monofluoride; NTL 50; TLD 100; TLD 700; Trilithium trifluoride
7789244 LiF+ lithium fluoride cation InChI=1S/FH.Li/h1H;/q;+2/p-1 VOIKZQGSXXBFOJ-UHFFFAOYSA-M [Li+]F  
14034798 HOF Hypofluorous acid InChI=1S/FHO/c1-2/h2H AQYSYJUIMQTRMV-UHFFFAOYSA-N FO   Hypofluorous acid
18130740 FHF- FHF- InChI=1S/F2H/c1-3-2/q-1 LJRMFMQHZAVYNS-UHFFFAOYSA-N  
18130740 FHF FHF InChI=1S/2FH/h2*1H F.F  
13453526 HCF Fluoromethylene InChI=1S/CHF/c1-2/h1H YUCFVHQCAFKDQG-UHFFFAOYSA-N [CH]F   Fluoromethylene
15861059 NH2F monofluoroamine InChI=1S/FH2N/c1-2/h2H2 MDQRDWAGHRLBPA-UHFFFAOYSA-N NF   Monofluoroammonia; Fluoroamine
30664121 H2F2 Hydrogen fluoride dimer InChI=1S/F2H2/c1-3-2/h1H WGRFAFFYKGIUGZ-UHFFFAOYSA-N F.F   Hydrogen fluoride dimer
3744294 CH2F fluoromethyl radical InChI=1S/CH2F/c1-2/h1H2 VUWZPRWSIVNGKG-UHFFFAOYSA-N [CH2]F   Methyl, fluoro-; Methyl radical, fluoro-
593533 CH3F Methyl fluoride InChI=1S/CH3F/c1-2/h1H3 NBVXSUQYWXRMNV-UHFFFAOYSA-N CF   Fluoromethane; Freon 41; Methane, fluoro-; Methyl fluoride; UN 2454
558214 CD3F methylfluoride-d3 InChI=1S/CH3F/c1-2/h1H3/i1D3 NBVXSUQYWXRMNV-FIBGUPNXSA-N CF   Fluoromethane-d3
12185056 Ne2 Neon dimer InChI=1S/Ne2/c1-2 AOYLJFJXTMPVQU-UHFFFAOYSA-N [Ne][Ne]  
12185056 Ne2+ Neon dimer cation InChI=1S/Ne2/c1-2/q+1 ZWVRTUFYOQFTNE-UHFFFAOYSA-N [Ne+][Ne]  
12333492 NaLi- lithium sodium anion InChI=1S/Li.Na/q-1; YRVOGPYJQZFITP-UHFFFAOYSA-N [Na][Li-]  
12333492 NaLi- lithium sodium anion InChI=1/Li.Na/q;-1/rLiNa/c1-2/q-1 YRVOGPYJQZFITP-CZHMQCEGNA-N [Na][Li-]  
12333492 NaLi lithium sodium InChI=1S/Li.Na VVNXEADCOVSAER-UHFFFAOYSA-N [Na][Li]  
12333492 NaLi lithium sodium InChI=1/Li.Na/rLiNa/c1-2 VVNXEADCOVSAER-BUZOBWEENA-N  
12333492 NaLi+ lithium sodium cation InChI=1S/Li.Na/q;+1 QTZZYFLLQVLUNF-UHFFFAOYSA-N [Na][Li+]  
12333492 NaLi+ lithium sodium cation InChI=1/Li.Na/q;+1/rLiNa/c1-2/q+1 QTZZYFLLQVLUNF-NARQAQEANA-N  
25681792 Na2- sodium dimer anion InChI=1S/2Na/q;-1 BNGLLXLLJXMLTN-UHFFFAOYSA-N [Na]=[Na-]  
25681792 Na2- sodium dimer anion InChI=1/2Na/q;-1/rNa2/c1-2/q-1 BNGLLXLLJXMLTN-OKUGHGEBNA-N [Na]=[Na-]  
25681792 Na2 Sodium diatomic InChI=1S/2Na QXNVGIXVLWOKEQ-UHFFFAOYSA-N [Na][Na]   Sodium; Sodium dimer; disodium
25681792 Na2+ sodium dimer cation InChI=1S/2Na/q;+1 YWCMJCGHOWDIIZ-UHFFFAOYSA-N [Na][Na+]  
25681792 Na2+ sodium dimer cation InChI=1/2Na/q;+1/rNa2/c1-2/q+1 YWCMJCGHOWDIIZ-TWAVBOHPNA-N [Na][Na+]  
9000368 NaBe Sodium Beryllium InChI=1S/Be.Na ONDNJMVOFFRRKV-UHFFFAOYSA-N [Na][Be]  
9000368 NaBe Sodium Beryllium InChI=1/Be.Na/rBeNa/c1-2 ONDNJMVOFFRRKV-ZVNBMPAFNA-N  
12401864 NaO- sodium oxide anion InChI=1S/Na.O/q;-1 BDJROSQLJNXSHE-UHFFFAOYSA-N  
12401864 NaO- sodium oxide anion InChI=1/Na.O/q;-1/rNaO/c1-2/q-1 BDJROSQLJNXSHE-CRUIXLRBNA-N  
12401864 NaO sodium monoxide InChI=1S/Na.O IVAOQJNBYYIDSI-UHFFFAOYSA-N [Na][O]   Calcined soda; Disodium monoxide; Disodium oxide; Sodium monoxide; Sodium oxide; UN 1825
12401864 NaO+ sodium oxide cation InChI=1S/Na.O/q+1; MOTFHFGUYDZINO-UHFFFAOYSA-N [Na+][O]  
12401864 NaO+ sodium oxide cation InChI=1/Na.O/q+1;/rNaO/c1-2/q+1 MOTFHFGUYDZINO-LPHZKHJKNA-N  
1310732 NaOH sodium hydroxide InChI=1S/Na.H2O/h;1H2/q+1;/p-1 HEMHJVSKTPXQMS-UHFFFAOYSA-M [Na]O   Aetznatron; Ascarite; Caustic soda; Collo-Grillrein; Collo-Tapetta; Fuers Rohr; Hydroxyde de sodium; Liquid-plumr; Lye; Natriumhydroxid; Natriumhydroxyde; Plung; Rohrputz; Rohrreiniger Rofix; Soda lye; Soda, caustic; Sodio(idrossido di); Sodium hydrate; Sodium Hydroxide; Sodium hydroxide (Na(OH)); Sodium hydroxide, anhydrous; Sodium(hydroxyde de); White caustic
7681494 NaF- sodium fluoride anion InChI=1S/FH.Na/h1H;/p-1 SRLLRIILXLQLHZ-UHFFFAOYSA-M [Na][F-]  
7681494 NaF sodium fluoride InChI=1S/FH.Na/h1H;/q;+1/p-1 PUZPDOWCWNUUKD-UHFFFAOYSA-M [Na]F   Alcoa sodium fluoride; Antibulit; Checkmate; FDA 0101; Floridine; Florocid; Fluonatril; Fluoraday; Fluorid sodny; Fluoride, sodium; Fluorident; Fluorinse; Fluorol; Fluorure de sodium; Flura; Flura Drops; Flurexal; Flursol; Flux; Fungol B; Gel II; Karidium; Koreberon; Les-Cav; Liquiflur; Luride; Minute-Gel; NCI-C55221; Ossalin; Ossin; Osteopor-F; Pediaflor; Pergantene; Roach salt; Sodium flouride; Sodium Fluoride; Sodium fluoride (Na2F2); Sodium fluoride (NaF); Sodium fluoride cyclic dimer; Sodium fluorure; Sodium hydrofluoride; Sodium monofluoride; t-Fluoride; Zymafluor; Xaridium; Villiaumite
7681494 NaF+ sodium fluoride cation InChI=1S/F.Na/q;+1 DWGKQXLFIDDJLI-UHFFFAOYSA-N [Na+]F  
9000370 NaMg Sodium Magnesium InChI=1S/Mg.Na NEMFQSKAPLGFIP-UHFFFAOYSA-N [Na][Mg]  
9000370 NaMg Sodium Magnesium InChI=1/Mg.Na/rMgNa/c1-2 NEMFQSKAPLGFIP-PQNAKPCQNA-N  
9000367 LiMg Lithium magnesium InChI=1S/Li.Mg GCICAPWZNUIIDV-UHFFFAOYSA-N [Li][Mg]  
9000367 LiMg Lithium magnesium InChI=1/Li.Mg/rLiMg/c1-2 GCICAPWZNUIIDV-PEEIPLGNNA-N  
29904798 Mg2- magnesium dimer anion InChI=1S/2Mg/q;-1 CISLHUYDBIYHAP-UHFFFAOYSA-N [Mg]#[Mg-]  
29904798 Mg2- magnesium dimer anion InChI=1/2Mg/q;-1/rMg2/c1-2/q-1 CISLHUYDBIYHAP-DMHMWSDXNA-N [Mg]#[Mg-]  
29904798 Mg2 Magnesium diatomic InChI=1S/2Mg HZZOEADXZLYIHG-UHFFFAOYSA-N [Mg]=[Mg]   Magnesium; Magnesium dimer; dimagnesium
29904798 Mg2+ magnesium dimer cation InChI=1S/2Mg/q;+1 HRLTYPKXXQLYKW-UHFFFAOYSA-N [Mg][Mg+]  
29904798 Mg2+ magnesium dimer cation InChI=1/2Mg/q;+1/rMg2/c1-2/q+1 HRLTYPKXXQLYKW-SNICHUAKNA-N [Mg][Mg+]  
81099061 BeMg Beryllium Magnesium InChI=1S/Be.Mg [Be][Mg]  
1309484 MgO- magnesium oxide anion InChI=1S/Mg.O/q-1; KGNGYGXQTQANKO-UHFFFAOYSA-N [Mg][O-]  
1309484 MgO- magnesium oxide anion InChI=1/Mg.O/q;-1/rMgO/c1-2/q-1 UDYXJSKNNDLQKX-BXPLQSITNA-N  
1309484 MgO magnesium oxide InChI=1S/Mg.O CPLXHLVBOLITMK-UHFFFAOYSA-N [Mg]=O   Akro-mag; Animag; Calcined brucite; Calcined magnesia; Calcined magnesite; Granmag; Magcal; Magchem 100; Maglite; Magnesia; Magnesia usta; Magnesium Oxide; Magnesium oxide (MgO); Magnezu tlenek; Magox; Magox 85; Magox 90; Magox 95; Magox 98; Magox op; Marmag; Oxymag; Periclase; Seawater magnesia
1309484 MgO+ magnesium oxide cation InChI=1S/Mg.O/q;+1 WWJAFWJWKCNAED-UHFFFAOYSA-N [Mg+][O]  
12141116 MgOH magnesium hydroxide InChI=1S/Mg.H2O/h;1H2/q+1;/p-1 UNYOJUYSNFGNDV-UHFFFAOYSA-M [Mg]O   Magnesium hydroxide
12141116 MgOH magnesium hydroxide InChI=1/Mg.H2O/h;1H2/q+1;/p-1/rHMgO/c1-2/h2H UNYOJUYSNFGNDV-MGFXJTNPNA-M   Magnesium hydroxide
14953287 MgF- magnesium fluoride anion InChI=1S/FH.Mg/h1H;/p-1 YCMRNUFUPJPNJS-UHFFFAOYSA-M [Mg][F-]  
14953287 MgF- magnesium fluoride anion InChI=1/FH.Mg/h1H;/p-1/rFMg/c1-2/q-1 YCMRNUFUPJPNJS-NQXQAOKTNA-M [Mg][F-]  
14953287 MgF Magnesium monofluoride InChI=1S/FH.Mg/h1H;/q;+1/p-1 WSXHQDSJUJYQDO-UHFFFAOYSA-M [Mg]F   Magnesium fluoride
14953287 MgF+ magnesium fluoride cation InChI=1S/FH.Mg/h1H;/q;+2/p-1 IVKQCNNOVDWFRO-UHFFFAOYSA-M [Mg+]F  
32752946 Al2- aluminum dimer anion InChI=1S/2Al/q;-1 IDPICEGAWIXDJU-UHFFFAOYSA-N [Al]#[Al-]  
32752946 Al2- aluminum dimer anion InChI=1/2Al/q;-1/rAl2/c1-2/q-1 IDPICEGAWIXDJU-WZCMVCQXNA-N [Al]#[Al-]  
32752946 Al2 Aluminum diatomic InChI=1S/2Al QSDQMOYYLXMEPS-UHFFFAOYSA-N [Al]#[Al]   Aluminum; dialuminum
32752946 Al2+ aluminum dimer cation InChI=1S/2Al/q;+1 FTMHZEODMLVFLK-UHFFFAOYSA-N [Al]=[Al+]  
12004307 Al2H6 dialane InChI=1S/2Al.6H VRAIHTAYLFXSJJ-UHFFFAOYSA-N  
12004307 Al2H6 dialane InChI=1/2Al.6H/rAl2H6/c3-1-2(3)4-1/h1-2H2 VRAIHTAYLFXSJJ-UXBQRSFMNA-N  
37265944 AlC Aluminum carbide InChI=1S/C.Al CGOMEZFCOFKDAD-UHFFFAOYSA-N [Al]=[C]  
12250429 BAl Boron Aluminum InChI=1S/Al.B [B][Al]  
24304005 AlN- aluminum mononitride anion InChI=1S/Al.N/q;-1 FEODAVSWLJSVMT-UHFFFAOYSA-N [Al]=[N-]  
24304005 AlN- aluminum mononitride anion InChI=1/Al.N/q;-1/rAlN/c1-2/q-1 FEODAVSWLJSVMT-FULZEAINNA-N [Al]=[N-]  
24304005 AlN Aluminum nitride InChI=1S/Al.N PIGFYZPCRLYGLF-UHFFFAOYSA-N [Al]#N  
24304005 AlN+ aluminum mononitride cation InChI=1S/Al.N/q+1; FOULOHQKOXGYKD-UHFFFAOYSA-N [Al+]=[N]  
14457648 AlO- Aluminum monoxide anion InChI=1S/Al.O/q;-1 CFOAGJJIFDBIGW-UHFFFAOYSA-N [Al][O-]  
14457648 AlO Aluminum monoxide InChI=1S/Al.O AIRCTMFFNKZQPN-UHFFFAOYSA-N [Al]=O   Aluminum oxide
14457648 AlO+ aluminum monoxide cation InChI=1S/Al.O/q+1; AENDPCOLKHDBIA-UHFFFAOYSA-N [Al+]=O  
14457648 AlO+ aluminum monoxide cation InChI=1/Al.O/q+1;/rAlO/c1-2/q+1 AENDPCOLKHDBIA-JWQLGQMPNA-N [Al+]=O  
13595829 AlF- Aluminum monofluoride anion InChI=1S/Al.FH/h;1H/p-1 MLRRTXJBDYYWFO-UHFFFAOYSA-M [Al][F-]  
13595829 AlF- Aluminum monofluoride anion InChI=1/Al.FH/h;1H/p-1/rAlF/c1-2/q-1 MLRRTXJBDYYWFO-ODKZLNRCNA-M  
13595829 AlF Aluminum monofluoride InChI=1S/Al.FH/h;1H/q+1;/p-1 APURLPHDHPNUFL-UHFFFAOYSA-M [Al]F   Aluminum fluoride; Aluminum monofluoride; aluminum(I) fluoride
13595829 AlF+ Aluminum monofluoride cation InChI=1S/Al.FH/h;1H/q+2;/p-1 RGHMOOXWBKVSBE-UHFFFAOYSA-M [Al+]F  
13595829 AlF+ Aluminum monofluoride cation InChI=1/Al.FH/h;1H/q+2;/p-1/rAlF/c1-2/q+1 RGHMOOXWBKVSBE-GZCZCILFNA-M  
12597352 Si2- silcon dimer anion InChI=1S/Si2/c1-2/q-1 ZJQANMVDLHPKNU-UHFFFAOYSA-N [Si]#[Si-]  
12597352 Si2 Silicon diatomic InChI=1S/Si2/c1-2 NTQGILPNLZZOJH-UHFFFAOYSA-N [Si]=[Si]   Silicon dimer; silicon dimer ; disilicon
12597352 Si2+ silcon dimer cation InChI=1S/Si2/c1-2/q+1 MEMLCQNRJARANC-UHFFFAOYSA-N [Si]#[Si+]  
409212 SiC- silicon monocarbide anion InChI=1S/CSi/c1-2/q-1 JIEIEMAFCBWKKB-UHFFFAOYSA-N [Si]#[C-]  
409212 SiC silicon monocarbide InChI=1S/CSi/c1-2 HBMJWWWQQXIZIP-UHFFFAOYSA-N [Si]#[C]   Silicon carbide
409212 SiC+ silicon monocarbide cation InChI=1S/CSi/c1-2/q+1 ONANOXGDHXUCRI-UHFFFAOYSA-N [Si]#[C+]  
51067846 CH2SiH2 silaethylene InChI=1S/CH4Si/c1-2/h1-2H2 CBZNDCXNWNCBHK-UHFFFAOYSA-N C=Si  
992949 CH3SiH3 methyl silane InChI=1S/CH6Si/c1-2/h1-2H3 UIUXUFNYAYAMOE-UHFFFAOYSA-N [SiH3]C   Methylsilane; Silaethane; Silane, methyl-
1590870 Si2H6 disilane InChI=1S/H6Si2/c1-2/h1-2H3 PZPGRFITIJYNEJ-UHFFFAOYSA-N [SiH3][SiH3]   Disilane; Silicoethane
12033602 SiN- silicon mononitride anion InChI=1S/NSi/c1-2/q-1 HJLUGXGKUYDMTQ-UHFFFAOYSA-N [Si]=[N-]  
12033602 SiN Silicon nitride InChI=1S/NSi/c1-2 NCLWWTWAYQTPBU-UHFFFAOYSA-N [Si]#N   Silicon nitride; Silicon nitride (SiN)
12033602 SiN+ silicon mononitride cation InChI=1S/NSi/c1-2/q+1 DTKKAOJCCCLENN-UHFFFAOYSA-N [Si+]#N  
10097286 SiO- silicon monoxide anion InChI=1S/OSi/c1-2/q-1 KPCFRGHQOVXAQS-UHFFFAOYSA-N [Si-]=O  
10097286 SiO Silicon monoxide InChI=1S/OSi/c1-2 LIVNPJMFVYWSIS-UHFFFAOYSA-N [Si][O]   Silicon monoxide; Silicon oxide; Silicon(II) oxide; Silylene, oxo-
10097286 SiO+ silicon monoxide cation InChI=1S/OSi/c1-2/q+1 PWVRFXMLYJICKR-UHFFFAOYSA-N [Si]#[O+]  
11128248 SiF- silicon monofluoride anion InChI=1S/FSi/c1-2/q-1 KUUGDSIWSVFCGC-UHFFFAOYSA-N [Si-]F  
11128248 SiF silicon monofluoride InChI=1S/FSi/c1-2 ZHPNWZCWUUJAJC-UHFFFAOYSA-N [Si]F   Fluorosilylidyne; Silicon fluoride; Silylidyne, fluoro-
11128248 SiF+ silicon monofluoride cation InChI=1S/FSi/c1-2/q+1 WZSRQTCBMBRHIN-UHFFFAOYSA-N [Si]=[F+]  
13537332 SiH3F monofluorosilane InChI=1S/FH3Si/c1-2/h2H3 XPBBUZJBQWWFFJ-UHFFFAOYSA-N [SiH3]F   Fluorosilane; Silane, fluoro-
12326851 CP- carbon monophosphide anion InChI=1S/CP/c1-2/q-1 UVQWQOUGJCVJLT-UHFFFAOYSA-N [C-]#P  
12326851 CP Carbon monophosphide InChI=1S/CP/c1-2 GDPLAAHPHNAIGW-UHFFFAOYSA-N [C]=[P]   Carbon phosphide
12326851 CP+ carbon monophosphide cation InChI=1S/CP/c1-2/q+1 QQOZTKRLBULFQD-UHFFFAOYSA-N [C]#[P+]  
12137643 SiP- Silicon monophosphide anion InChI=1S/PSi/c1-2/q-1 XUQPLOSHMXQBBQ-UHFFFAOYSA-N [Si]#[P-]  
12137643 SiP Silicon monophosphide InChI=1S/PSi/c1-2 FLRSUSDJUOANNM-UHFFFAOYSA-N [Si]#P  
12137643 SiP+ Silicon monophosphide cation InChI=1S/PSi/c1-2/q+1 CPJSRFNXHFFPHA-UHFFFAOYSA-N [Si]#[P+]  
12185090 P2- phosphorus dimer anion InChI=1S/P2/c1-2/q-1 NDHYILTXGGVEAB-UHFFFAOYSA-N [P]=[P-]  
12185090 P2 Phosphorus diatomic InChI=1S/P2/c1-2 FOBPTJZYDGNHLR-UHFFFAOYSA-N P#P   Phosphorus; Phosphorus dimer; Phosphorus dimer; phosphorus(III) phosphide
12185090 P2+ phosphorus dimer cation InChI=1S/P2/c1-2/q+1 GSQBFINVLXKPNU-UHFFFAOYSA-N P#[P+]  
20859738 AlP Aluminum monophosphide InChI=1S/Al.P PPNXXZIBFHTHDM-UHFFFAOYSA-N [Al]#P  
17739478 PN- phosphorus nitride anion InChI=1S/NP/c1-2/q-1 CMKZENUPWBHOLO-UHFFFAOYSA-N [P]=[N-]  
17739478 PN Phosphorus mononitride InChI=1S/NP/c1-2 AOPJVJYWEDDOBI-UHFFFAOYSA-N P#N   Phosphorous nitride; Phosphorus nitride
17739478 PN+ phosphorus nitride cation InChI=1S/NP/c1-2/q+1 AWCKEWBQZYTNFT-UHFFFAOYSA-N P#[N+]  
13817066 HPO HPO InChI=1S/HOP/c1-2/h1H DMGNFLJBACZMRM-UHFFFAOYSA-N P=O  
13817066 HPO+ HPO cation InChI=1S/HOP/c1-2/h2H/q+1 LDPFQYNIASWZRM-UHFFFAOYSA-N [PH+]=O  
6829523 HCP HCP InChI=1S/CHP/c1-2/h1H DPYPSJGRRFKXBE-UHFFFAOYSA-N C#P   CHP; Methinophosphide; Phosphaethyne; methylidynephosphine
61183537 CH2PH H2CPH InChI=1S/CH3P/c1-2/h2H,1H2 HIQXJRBKNONWAH-UHFFFAOYSA-N [CH2]=[PH]   Phosphethene; methylenephosphine
13445506 P2H4 H2PPH2 InChI=1S/H4P2/c1-2/h1-2H2 VURFVHCLMJOLKN-UHFFFAOYSA-N PP   Diphosphine
593544 CH3PH2 Methyl phosphine InChI=1S/CH5P/c1-2/h2H2,1H3 SAWKFRBJGLMMES-UHFFFAOYSA-N PC   Methylphosphane; Phosphine, methyl-; methylphosphine
56898761 CH3PH3+ methyl phosphine, protonated InChI=1S/CH5P/c1-2/h2H2,1H3/p+1 C[PH3+]   methylphophoranyl cation
14452665 PO- phosphorus monoxide anion InChI=1S/OP/c1-2/q-1 SFBRJKRKUUTKHL-UHFFFAOYSA-N [P-]=O  
14452665 PO Phosphorus monoxide InChI=1S/OP/c1-2 LFGREXWGYUGZLY-UHFFFAOYSA-N [P]=O   Phosphorus oxide
14452665 PO+ phosphorus monoxide cation InChI=1S/OP/c1-2/q+1 OWAFMGZRZPLCGM-UHFFFAOYSA-N O=[P+]  
13840409 H3PO Phosphine oxide InChI=1S/H3OP/c1-2/h2H3 MPQXHAGKBWFSNV-UHFFFAOYSA-N [PH3][O]  
25756870 H2POH Phosphinous acid InChI=1S/H3OP/c1-2/h1H,2H2 RYIOLWQRQXDECZ-UHFFFAOYSA-N PO  
25756870 H2POH Phosphinous acid InChI=1S/H3OP/c1-2/h1H,2H2 RYIOLWQRQXDECZ-UHFFFAOYSA-N PO  
16027922 PF- phosphorus monofluoride anion InChI=1S/FP/c1-2/q-1 KEZNWIPFMLYSGH-UHFFFAOYSA-N [P][F-]  
16027922 PF phosphorus monofluoride InChI=1S/FP/c1-2 QUQSORXWLOUIIW-UHFFFAOYSA-N [P]F   Phosphorus fluoride; Phosphorus monofluoride
16027922 PF+ phosphorus monofluoride cation InChI=1S/FP/c1-2/q+1 RLTICPCNBDVRPZ-UHFFFAOYSA-N [P+]F  
23550450 S2- sulfur dimer anion InChI=1S/S2/c1-2/q-1 XUIBOWWEJSQBHU-UHFFFAOYSA-N [S][S-]  
23550450 S2 Sulfur diatomic InChI=1S/S2/c1-2 MAHNFPMIPQKPPI-UHFFFAOYSA-N S=S   Sulfur; disulfur
23550450 S2+ sulfur dimer cation InChI=1S/S2/c1-2/q+1 YUWMVWRPXKPVMW-UHFFFAOYSA-N S=[S+]  
13827322 SO- sulfur monoxide anion InChI=1S/OS/c1-2/q-1 YDTOBKDNPZNIGM-UHFFFAOYSA-N [S][O-]  
13827322 SO- sulfur monoxide anion InChI=1S/HOS/c1-2/h2H/p-1 CKIBMZIMKMUBPA-UHFFFAOYSA-M [S-][O]  
13827322 SO Sulfur monoxide InChI=1S/OS/c1-2 XTQHKBHJIVJGKJ-UHFFFAOYSA-N S=O   Sulfur monoxide; Sulfur oxide
13827322 SO+ sulfur monoxide cation InChI=1S/OS/c1-2/q+1 CYYOEZLVUNBAAF-UHFFFAOYSA-N [S+]=O  
12401740 LiS Lithium monosulfide InChI=1S/Li.S JDZCKJOXGCMJGS-UHFFFAOYSA-N [Li][S]  
12401740 LiS+ Lithium sulfide cation InChI=1S/Li.S/q;+1 ZRSVLQQFHMQCTB-UHFFFAOYSA-N [Li][S+]  
13598226 BeS- Beryllium monosulfide anion InChI=1S/Be.S/q;-1 FVCMAVGATTVAJD-UHFFFAOYSA-N [Be][S-]  
13598226 BeS beryllium sulfide InChI=1S/Be.S FQDSYGKTHDFFCM-UHFFFAOYSA-N [Be]=S   Beryllium sulfide; Beryllium sulfide (BeS)
13598226 BeS+ Beryllium monosulfide cation InChI=1S/Be.S/q+1; KWQBMKYTDXSTDQ-UHFFFAOYSA-N [Be+][S]  
12281366 PS- phosphorus monosulfide anion InChI=1S/PS/c1-2/q-1 AWWBASURNVMANW-UHFFFAOYSA-N [P][S-]  
12281366 PS phosphorus sulfide InChI=1S/PS/c1-2 VKCLPVFDVVKEKU-UHFFFAOYSA-N [P]=S   Phosphorus sulfide
12281366 PS+ phosphorus monosulfide cation InChI=1S/PS/c1-2/q+1 WEKCTOSOWWEJEE-UHFFFAOYSA-N [P+]=S  
12251900 AlS- aluminum monosulfide anion InChI=1S/Al.S/q;-1 KNXXUHKICMOCRG-UHFFFAOYSA-N [Al][S-]  
12251900 AlS Aluminum sulfide InChI=1S/Al.S SLWLWUJHXQUDJS-UHFFFAOYSA-N [Al]=S   Aluminum sulfide
12251900 AlS+ aluminum monosulfide cation InChI=1S/Al.S/q+1; LDTBXNSCQSHUOV-UHFFFAOYSA-N [Al+]=S  
12228396 BS- boron monosulfide anion InChI=1S/BS/c1-2/q-1 NPEODCOHZMOQPS-UHFFFAOYSA-N [B][S-]  
12228396 BS boron sulfide InChI=1S/BS/c1-2 CPTTWDDSVZIXIO-UHFFFAOYSA-N [B]=S   Boron sulfide
12228396 BS+ boron monosulfide cation InChI=1S/BS/c1-2/q+1 PNXGKTMXUUBZOC-UHFFFAOYSA-N B#[S+]  
12504415 SiS- silicon monosulfide anion InChI=1S/SSi/c1-2/q-1 NCVGVEWFMIKLSL-UHFFFAOYSA-N [Si][S-]  
12504415 SiS silicon monosulfide InChI=1S/SSi/c1-2 DWFFKGPZNGKUPH-UHFFFAOYSA-N [Si]=S   Silicon monosulfide; Silicon sulfide; silicon(II) sulfide
12504415 SiS+ silicon monosulfide cation InChI=1S/SSi/c1-2/q+1 PEBIEMGFJNPPGQ-UHFFFAOYSA-N [Si+]=S  
12032369 MgS- magnesium sulfide anion InChI=1S/Mg.S/q;-1 OMNSZBQEMNOTLV-UHFFFAOYSA-N [Mg][S-]  
12032369 MgS magnesium sulfide InChI=1S/Mg.S SMDQFHZIWNYSMR-UHFFFAOYSA-N [Mg]=S   Magnesium sulfide; Magnesium sulfide (MgS)
12032369 MgS+ magnesium sulfide cation InChI=1S/Mg.S/q+1; ADIVIKVYSZQWHT-UHFFFAOYSA-N [S][Mg+]  
12033566 NS- nitrogen sulfide anion InChI=1S/NS/c1-2/q-1 OAXQFEMDGLNGOT-UHFFFAOYSA-N [N-]=S  
12033566 NS Mononitrogen monosulfide InChI=1S/NS/c1-2 QXTCFDCJXWLNAP-UHFFFAOYSA-N [N]=S   Nitrogen sulfide; Sulfur nitride
12033566 NS+ nitrogen sulfide cation InChI=1S/NS/c1-2/q+1 AEYFYSDAUZXUEI-UHFFFAOYSA-N N#[S+]  
115694774 NaS Sodium sulfide InChI=1S/Na.S BNOODXBBXFZASF-UHFFFAOYSA-N [Na][S]  
2944050 CS- carbon monosulfide anion InChI=1S/CS/c1-2/q-1 FSOZVKCVXLMCHJ-UHFFFAOYSA-N [C-]=S  
2944050 CS carbon monosulfide InChI=1S/CS/c1-2 DXHPZXWIPWDXHJ-UHFFFAOYSA-N [C]=S   Carbon sulfide
2944050 CS+ carbon monosulfide cation InChI=1S/CS/c1-2/q+1 ITHBHNXWPWSYRD-UHFFFAOYSA-N [C+]=S  
9000242 HNS- HNS- InChI=1S/HNS/c1-2/h1H/q-1 LVAUBKGSZLNRAL-UHFFFAOYSA-N [NH][S-]  
9000242 HNS HNS InChI=1S/HNS/c1-2/h1H GLBQVJGBPFPMMV-UHFFFAOYSA-N N=S  
36058283 HCS- Thioformyl anion InChI=1S/CHS/c1-2/h1H/q-1 VKAKQBQYOCBNIX-UHFFFAOYSA-N [CH-]=S  
36058283 HCS Thioformyl radical InChI=1S/CHS/c1-2/h1H RIFHJAODNHLCBH-UHFFFAOYSA-N [CH]=S  
36058283 HCS Thioformyl radical InChI=1S/CHS/c1-2/h1H RIFHJAODNHLCBH-UHFFFAOYSA-N [CH]=S  
36058283 HCS+ Thioformyl cation InChI=1S/CHS/c1-2/h1H/q+1 YOFNWWZZELAVRX-UHFFFAOYSA-N [CH+]=S  
14457853 HBS hydrogen boron sulfide InChI=1S/BHS/c1-2/h1H WGPDGCGYTCPFPX-UHFFFAOYSA-N B=S   Boron hydride sulfide; thioxoborane
14541243 HS2 Thiosulfeno radical InChI=1S/HS2/c1-2/h1H PYPQFOINVKFSJD-UHFFFAOYSA-N [S]S  
13465071 H2S2 Disulfane InChI=1S/H2S2/c1-2/h1-2H BWGNESOTFCXPMA-UHFFFAOYSA-N SS   Dihydrogen disulfide
865361 H2CS Thioformaldehyde InChI=1S/CH2S/c1-2/h1H2 DBTDEFJAFBUGPP-UHFFFAOYSA-N C=S   Thioformaldehyde; methanethial
7175759 CH3S thiomethoxy InChI=1S/CH3S/c1-2/h1H3 QSLPNSWXUQHVLP-UHFFFAOYSA-N C[S]   Methylthio radical
74931 CH3SH Methanethiol InChI=1S/CH4S/c1-2/h2H,1H3 LSDPWZHWYPCBBB-UHFFFAOYSA-N CS   Mercaptan methylique; Mercaptomethane; Methaanthiol; Methanethiol; Methanthiol; Methvtiolo; Methyl mercaptan; Methyl sulfhydrate; Methyl thioalcohol; Methylmercaptaan; Metilmercaptano; Rcra waste number U153; Thiomethanol; UN 1064
16068965 SF- sulfur monofluoride anion InChI=1S/FS/c1-2/q-1 AYOGQKFVPLTXLD-UHFFFAOYSA-N [S-]F  
16068965 SF Monosulfur monofluoride InChI=1S/FS/c1-2 YNAAFGQNGMFIHH-UHFFFAOYSA-N [S]F   Sulfur fluoride
16068965 SF+ sulfur monofluoride cation InChI=1S/FS/c1-2/q+1 MPXBIUQNSONLGM-UHFFFAOYSA-N S=[F+]  
17167554 PCl- phosphorus monochloride anion InChI=1S/ClP/c1-2/q-1 HTTQKARNUVOXPX-UHFFFAOYSA-N [P-]Cl  
17167554 PCl phosphorus chloride InChI=1S/ClP/c1-2 OKSUCCKLAIZTQH-UHFFFAOYSA-N [P]Cl   Phosphorus chloride
17167554 PCl+ phosphorus monochloride cation InChI=1S/ClP/c1-2/q+1 KLVGEFFETWPHOI-UHFFFAOYSA-N [P]=[Cl+]  
20583555 BCl- boron monochloride anion InChI=1S/BCl/c1-2/q-1 YNMCJRROYOHGQK-UHFFFAOYSA-N [B][Cl-]  
20583555 BCl boron monochloride InChI=1S/BCl/c1-2 GKCOJTRGYAUVSR-UHFFFAOYSA-N B#Cl   Boron monochloride; Chloroborane
20583555 BCl+ boron monochloride cation InChI=1S/BCl/c1-2/q+1 UFRRFTHZMBZYAS-UHFFFAOYSA-N [B+]Cl  
14989298 MgCl- magnesium monochloride anion InChI=1S/ClH.Mg/h1H;/p-1 FOGVNFMUZXDMTR-UHFFFAOYSA-M [Cl-][Mg]  
14989298 MgCl magnesium monochloride InChI=1S/ClH.Mg/h1H;/q;+1/p-1 FOSCDBCOYQJHPN-UHFFFAOYSA-M [Mg]Cl   Magnesium chloride
14989298 MgCl+ magnesium monochloride cation InChI=1S/ClH.Mg/h1H;/q;+2/p-1 UMLYWWAZKXNCCM-UHFFFAOYSA-M [Mg+]Cl  
14989301 ClO- chlorine monoxide anion InChI=1S/ClO/c1-2/q-1 WQYVRQLZKVEZGA-UHFFFAOYSA-N [O-]Cl  
14989301 ClO Monochlorine monoxide InChI=1S/ClO/c1-2 NHYCGSASNAIGLD-UHFFFAOYSA-N Cl[O]   Chlorine oxide
14989301 ClO+ chlorine monoxide cation InChI=1S/ClO/c1-2/q+1 GPDKCNQUFLZMCS-UHFFFAOYSA-N [O+]Cl  
14989323 SCl- sulfur monochloride anion InChI=1S/ClS/c1-2/q-1 SWONKXKBBKNEAW-UHFFFAOYSA-N [S-]Cl  
14989323 SCl sulfur monochloride InChI=1S/ClS/c1-2 NGDNCZPCIZNCQS-UHFFFAOYSA-N [S]Cl   Sulfur chloride
14989323 SCl+ sulfur monochloride cation InChI=1S/ClS/c1-2/q+1 QGRYHBGVSPNWQR-UHFFFAOYSA-N S=[Cl+]  
13814501 BeCl- beryllium monochloride anion InChI=1S/Be.ClH/h;1H/p-1 HZNAZXJRYRIZPD-UHFFFAOYSA-M [Be][Cl-]  
13814501 BeCl- beryllium monochloride anion InChI=1/Be.ClH/h;1H/p-1/rBeCl/c1-2/q-1 HZNAZXJRYRIZPD-NKASXHSXNA-M  
13814501 BeCl beryllium chloride InChI=1S/Be.ClH/h;1H/q+1;/p-1 LDIHXRVGMZWMIW-UHFFFAOYSA-M [Be]Cl   Beryllium chloride
13814501 BeCl+ beryllium monochloride cation InChI=1S/Be.ClH/h;1H/q+2;/p-1 OZJKWEFHBIQYGU-UHFFFAOYSA-M [Be+]Cl  
13966579 SiCl- silicon monochloride anion InChI=1S/ClSi/c1-2/q-1 MJZVKNVHJCHQAN-UHFFFAOYSA-N [Si-]Cl  
13966579 SiCl Clorosilylidyne InChI=1S/ClSi/c1-2 SLLGVCUQYRMELA-UHFFFAOYSA-N [Si]Cl   Clorosilylidyne
13966579 SiCl+ silicon monochloride cation InChI=1S/ClSi/c1-2/q+1 CFMKMSBGONFRNY-UHFFFAOYSA-N [Si+]Cl  
13595818 AlCl- aluminum monochloride anion InChI=1S/Al.ClH/h;1H/p-1 CFMUQTZUSZJTAW-UHFFFAOYSA-M [Al][Cl-]  
13595818 AlCl Aluminum monochloride InChI=1S/Al.ClH/h;1H/q+1;/p-1 IZMHKHHRLNWLMK-UHFFFAOYSA-M [Al]Cl   Aluminum chloride; Aluminum monochloride; aluminum(I) chloride
13595818 AlCl Aluminum monochloride InChI=1/Al.ClH/h;1H/q+1;/p-1/rAlCl/c1-2 IZMHKHHRLNWLMK-XAXYIUINNA-M [Al]Cl   Aluminum chloride; Aluminum monochloride; aluminum(I) chloride
13595818 AlCl+ aluminum monochloride cation InChI=1S/Al.ClH/h;1H/q+2;/p-1 CFMUQTZUSZJTAW-UHFFFAOYSA-M [Al+]Cl  
12190759 NCl- nitrogen monochloride anion InChI=1S/ClN/c1-2/q-1 QCZSUQYYROQMNS-UHFFFAOYSA-N [N-]Cl  
12190759 NCl nitrogen monochloride InChI=1S/ClN/c1-2 FCRWGDJBFPDQPO-UHFFFAOYSA-N [N]Cl  
12190759 NCl+ nitrogen monochloride cation InChI=1S/ClN/c1-2/q+1 CJYGRGOTNJSGDW-UHFFFAOYSA-N [N]=[Cl+]  
7647145 NaCl- sodium chloride anion InChI=1S/ClH.Na/h1H;/p-1 OTNVGWMVOULBFZ-UHFFFAOYSA-M [Na][Cl-]  
7647145 NaCl Sodium Chloride InChI=1S/ClH.Na/h1H;/q;+1/p-1 FAPWRFPIFSIZLT-UHFFFAOYSA-M [Na]Cl   Ayr; Common salt; Dendritis; Extra fine 200 salt; Extra fine 325 salt; Flexivial; Gingivyl; Halite; Hyposaline; Iodized salt; Natriumchlorid; Purex; Rock salt; Saline; Salt; Sea salt; Slow Sodium; Sodium chloric; Sodium Chloride; Sodium chloride (Na4Cl4); Sodium chloride (NaCl); Sodium chloride brine, purified; Sodium chloride, hypertonic; Sodium chloride, isotonic; Sodium monochloride; SS Salt; Sterling; Table salt; TOP FLAKE; USP sodium chloride; Trisodium trichloride; White crystal
7647145 NaCl+ sodium chloride cation InChI=1S/ClH.Na/h1H;/q;+2/p-1 KMAHCUJTNYBKDG-UHFFFAOYSA-M [Na+]Cl  
7447418 LiCl- lithium chloride anion InChI=1S/ClH.Li/h1H;/p-1 PZLXYMQOCNYUIO-UHFFFAOYSA-M [Li][Cl-]  
7447418 LiCl lithium chloride InChI=1S/ClH.Li/h1H;/q;+1/p-1 KWGKDLIKAYFUFQ-UHFFFAOYSA-M [Li]Cl   Chlorku litu; Chlorure de lithium; Lithium chloride; Lithium chloride (LiCl)
7447418 LiCl+ lithium chloride cation InChI=1S/ClH.Li/h1H;/q;+2/p-1 RMVAXWALTOISFB-UHFFFAOYSA-M [Li][Cl+]  
7790898 ClF- clorine monofluoride anion InChI=1S/ClF/c1-2/q-1 LDLDQLAJXGYORN-UHFFFAOYSA-N Cl[F-]  
7790898 ClF Chlorine monofluoride InChI=1S/ClF/c1-2 OMRRUNXAWXNVFW-UHFFFAOYSA-N ClF   Chlorine fluoride; Chlorine monofluoride; Chlorofluoride; Fluorine chloride
7790898 ClF+ clorine monofluoride cation InChI=1S/ClF/c1-2/q+1 BFNXPMYZRJXOIV-UHFFFAOYSA-N Cl[F+]  
7782505 Cl2- chlorine diatomic anion InChI=1S/Cl2/c1-2/q-1 CGCDOKHAYHELEG-UHFFFAOYSA-N [Cl-]Cl  
7782505 Cl2 Chlorine diatomic InChI=1S/Cl2/c1-2 KZBUYRJDOAKODT-UHFFFAOYSA-N ClCl   Bertholite; Chloor; Chlor; Chlore; Chlorine; Chlorine mol.; Cloro; Molecular chlorine; UN 1017; dichlorine
7782505 Cl2+ chlorine diatomic cation InChI=1S/Cl2/c1-2/q+1 IPYDCMMBWLZPDH-UHFFFAOYSA-N [Cl+]Cl  
3889767 CCl- carbon monochloride anion InChI=1S/CCl/c1-2/q-1 PMHXNYGAOGPVKN-UHFFFAOYSA-N [C-]Cl  
3889767 CCl carbon monochloride InChI=1S/CCl/c1-2 BBFYMZCRBPASGM-UHFFFAOYSA-N [C]Cl   Chloromethylidyne
3889767 CCl+ carbon monochloride cation InChI=1S/CCl/c1-2/q+1 ALXFPMMCBFNYBQ-UHFFFAOYSA-N [C+]Cl  
2108205 HCCl Chloromethylene InChI=1S/CHCl/c1-2/h1H LKYXEULZVGJVTG-UHFFFAOYSA-N [CH]Cl  
2108205 HCCl Chloromethylene InChI=1S/CHCl/c1-2/h1H LKYXEULZVGJVTG-UHFFFAOYSA-N [CH]Cl  
7790923 HOCl hypochlorous acid InChI=1S/ClHO/c1-2/h2H QWPPOHNGKGFGJK-UHFFFAOYSA-N ClO   Hypochlorous acid
13770224 DOCl Hypochlorous acid-d InChI=1S/ClHO/c1-2/h2H/i2D QWPPOHNGKGFGJK-VMNATFBRSA-N O(Cl)[2H]   DOCl; Hypochlorous acid-D
10599903 NH2Cl chloramine InChI=1S/ClH2N/c1-2/h2H2 QDHHCQZDFGDHMP-UHFFFAOYSA-N NCl   Chloramide; Chloroamine; Monochloramide; Monochloramine; Monochloroamine; Monochloroammonia
13465786 SiH3Cl chlorosilane InChI=1S/ClH3Si/c1-2/h2H3 KOPOQZFJUQMUML-UHFFFAOYSA-N [SiH3]Cl   Chlorosilane; Silane, chloro-
1111893 CD3Cl methyl chloride d3 InChI=1S/CH3Cl/c1-2/h1H3/i1D3 NEHMKBQYUWJMIP-FIBGUPNXSA-N [2H][C]([2H])([2H])Cl   chloromethane-d3
74873 CH3Cl Methyl chloride InChI=1S/CH3Cl/c1-2/h1H3 NEHMKBQYUWJMIP-UHFFFAOYSA-N CCl   Artic; Chloor-methaan; Chlor-methan; Chloromethane; Chlorure de methyle; Clorometano; Cloruro di metile; Freon 40; Methane, chloro-; Methyl chloride; Methylchlorid; Metylu chlorek; Monochloromethane; R 40; Rcra waste number U045; UN 1063
12595594 Ar2 Argon dimer InChI=1S/2Ar XMPZLAQHPIBDSO-UHFFFAOYSA-N [Ar][Ar]  
12030830 LiK Lithium Potassium InChI=1S/K.Li OBTSLRFPKIKXSZ-UHFFFAOYSA-N [Li][K]  
12056290 NaK Sodium Potassium InChI=1S/K.Na BITYAPCSNKJESK-UHFFFAOYSA-N [Na][K]  
25681805 K2 Potassium dimer InChI=1S/2K ZDHURYWHEBEGHO-UHFFFAOYSA-N [K][K]  
12401706 KO Potassium monoxide InChI=1S/K.O RQPCXPDUSNVHSU-UHFFFAOYSA-N [K][O]  
12401706 KO+ Potassium monoxide cation InChI=1S/K.O/q;+1 YWUVUBHYCWZIPY-UHFFFAOYSA-N [K][O+]  
7789233 KF Potassium Fluoride InChI=1S/FH.K/h1H;/q;+1/p-1 NROKBHXJSPEDAR-UHFFFAOYSA-M [K]F  
7447407 KCl Potassium Chloride InChI=1S/ClH.K/h1H;/q;+1/p-1 WCUXLLCKKVVCTQ-UHFFFAOYSA-M [K]Cl  
12595856 Ca2 Calcium dimer InChI=1S/2Ca CPGKMLVTFNUAHL-UHFFFAOYSA-N [Ca][Ca]   dicalcium
1305788 CaO Calcium monoxide InChI=1S/Ca.O ODINCKMPIJJUCX-UHFFFAOYSA-N [Ca]=O   Calcium oxide; Lime; Calcia; Calx
12177672 CaOH Calcium monohydroxide InChI=1S/Ca.H2O/h;1H2/q+1;/p-1 KIZFHUJKFSNWKO-UHFFFAOYSA-M [Ca]O  
15606710 CaCl calcium monochloride InChI=1S/Ca.ClH/h;1H/q+1;/p-1 WGPMOVAPQPJDDK-UHFFFAOYSA-M [Ca]Cl  
13827264 CaF Calcium monofluoride InChI=1S/Ca.FH/h;1H/q+1;/p-1 PMJVACMPRFHIPZ-UHFFFAOYSA-M [Ca]F  
12059915 ScO Scandium monoxide InChI=1S/O.Sc AXJFPMGRQPKZLD-UHFFFAOYSA-N [Sc][O]  
14017335 ScF Scandium monofluoride InChI=1S/FH.Sc/h1H;/q;+1/p-1 IASCHBSZTVAFET-UHFFFAOYSA-M [Sc]F  
25583204 TiN Titanium mononitride InChI=1S/N.Ti NRTOMJZYCJJWKI-UHFFFAOYSA-N [Ti][N]  
12137201 TiO Titanium monoxide InChI=1S/O.Ti OGIDPMRJRNCKJF-UHFFFAOYSA-N [Ti][O]  
20190061 TiCl Titanium Monochloride InChI=1S/ClH.Ti/h1H;/q;+1/p-1 [Ti]Cl  
12035982 VO Vanadium monoxide InChI=1S/O.V IBYSTTGVDIFUAY-UHFFFAOYSA-N [V][O]  
12190704 Cu2 Copper dimer InChI=1S/2Cu ALKZAGKDWUSJED-UHFFFAOYSA-N [Cu][Cu]  
9000231 CuCH3 monomethyl copper InChI=1S/CH3.Cu/h1H3; HRNSPWKFRJGQEC-UHFFFAOYSA-N [Cu]C  
9000231 CuCH3 monomethyl copper InChI=1/CH3.Cu/h1H3;/rCH3Cu/c1-2/h1H3 HRNSPWKFRJGQEC-CRCSLUCGNA-N [Cu]C  
1317380 CuO Copper Monoxide InChI=1S/Cu.O QPLDLSVMHZLSFG-UHFFFAOYSA-N [Cu]=O   Copper monooxide; Copper(ii) oxide; Cupric oxide; Copper oxide; Copper(II) oxide
7758896 CuCl Copper monochloride InChI=1S/ClH.Cu/h1H;/q;+1/p-1 OXBLHERUFWYNTN-UHFFFAOYSA-M [Cu]Cl   Cuprous chloride; Copper(I) chloride; Copper chloride
13478416 CuF Copper monofluoride InChI=1S/Cu.FH/h;1H/q+1;/p-1 BMRUOURRLCCWHB-UHFFFAOYSA-M [Cu]F   Copper fluoride; copper(I) fluoride
115410770 ZnCH2 Zinc methylene InChI=1S/CH2.Zn/h1H2; SNESWYIMTAYTPV-UHFFFAOYSA-N C=[Zn]  
115410770 ZnCH2 Zinc methylene InChI=1S/CH2.Zn/h1H2; SNESWYIMTAYTPV-UHFFFAOYSA-N C=[Zn]  
42217981 ZnCH3 Zinc monomethyl InChI=1S/CH3.Zn/h1H3; BQWIWXUEEOBUTH-UHFFFAOYSA-N [Zn]C  
1314132 ZnO zinc monoxide InChI=1S/O.Zn XLOMVQKBTHCTTD-UHFFFAOYSA-N [Zn]=O   Zinc oxide; zinc(II) oxide
1314983 ZnS Zinc sulfide InChI=1S/S.Zn WGPCGCOKHWGKJJ-UHFFFAOYSA-N [Zn][S]  
9000151 ZnCl Zinc monochloride InChI=1S/ClH.Zn/h1H;/q;+1/p-1 ZXYNGLRGFYLTQZ-UHFFFAOYSA-M [Zn]Cl  
9000139 ZnF- Zinc monofluoride anion InChI=1S/FH.Zn/h1H;/p-1 PNJFCQNOBYADBD-UHFFFAOYSA-M [Zn][F-]  
9000139 ZnF Zinc monofluoride InChI=1S/FH.Zn/h1H;/q;+1/p-1 XXLJNWABHZTVSW-UHFFFAOYSA-M [Zn]F  
9000139 ZnF+ Zinc monofluoride cation InChI=1S/FH.Zn/h1H;/q;+2/p-1 RXHSRIRNCBBJAF-UHFFFAOYSA-M [Zn+]F  
74508240 Ga2 Gallium diatomic InChI=1S/2Ga [Ga][Ga]  
12140588 Ga2H6 digallane InChI=1S/2Ga.6H GFQCQFDOQMRGIQ-UHFFFAOYSA-N  
12140588 Ga2H6 digallane InChI=1/2Ga.6H/rGa2H6/c3-1-2(3)4-1/h1-2H2 GFQCQFDOQMRGIQ-DFALRJEUNA-N  
25617974 GaN Gallium mononitride InChI=1S/Ga.N JMASRVWKEDWRBT-UHFFFAOYSA-N [Ga][N]   Gallium nitride
12024087 GaO Gallium monoxide InChI=1S/Ga.O XCZLSTLZPIRTRY-UHFFFAOYSA-N [Ga]=O  
17108859 GaCl Gallium monochloride InChI=1S/ClH.Ga/h1H;/q;+1/p-1 XOYLJNJLGBYDTH-UHFFFAOYSA-M [Ga]Cl  
13966784 GaF Gallium monofluoride InChI=1S/FH.Ga/h1H;/q;+1/p-1 CXPXVVXGLWMDKK-UHFFFAOYSA-M [Ga]F  
12334268 GeC Germanium monocarbide InChI=1S/CGe/c1-2 DZWOAPKTBKPJAH-UHFFFAOYSA-N [Ge][C]  
12596053 Ge2 Germanium dimer InChI=1S/Ge2/c1-2 VXGHASBVNMHGDI-UHFFFAOYSA-N [Ge][Ge]  
1449656 GeH3CH3 methyl germane InChI=1S/CH6Ge/c1-2/h1-2H3 FOTXTBSEOHNRCB-UHFFFAOYSA-N [GeH3]C  
12025320 GeS Germanium monosulfide InChI=1S/GeS/c1-2 [Ge]=S  
20619163 GeO Germanium monoxide InChI=1S/GeO/c1-2 PVADDRMAFCOOPC-UHFFFAOYSA-N [Ge][O]   germanium(II) oxide
14929465 GeF Germanium monofluoride InChI=1S/FGe/c1-2 HHFCFXJTAZTLAO-UHFFFAOYSA-N [Ge]F  
9000388 GeCl Germanium monochloride InChI=1S/ClGe/c1-2 MFWRCAQESKCGKS-UHFFFAOYSA-N [Ge]Cl  
12255333 AsP Arsenic monophosphide InChI=1S/AsP/c1-2 CFLINJYOEUVYMI-UHFFFAOYSA-N [As][P]  
23878468 As2 Arsenic diatomic InChI=1S/As2/c1-2 FFCZHQLUEDCQKI-UHFFFAOYSA-N [As]#[As]  
26754983 AsN Arsenic mononitride InChI=1S/AsN/c1-2 FOVWHVGDSVSEMU-UHFFFAOYSA-N [As][N]  
1303000 GaAs Gallium arsenide InChI=1S/As.Ga JBRZTFJDHDCESZ-UHFFFAOYSA-N [Ga]#[As]  
12005991 AsO Arsenic monoxide InChI=1S/AsO/c1-2 GPSSQIRGCXEBSH-UHFFFAOYSA-N [As]=O  
15120135 AsF Arsenic monofluoride InChI=1S/AsF/c1-2 VUFLKUMKDWHEMK-UHFFFAOYSA-N [As]F  
16674183 CSe- Carbon monoselenide anion InChI=1S/CSe/c1-2/q-1 VMQIAGBKRWJBEG-UHFFFAOYSA-N [C-]=[Se]  
16674183 CSe Carbon monoselenide InChI=1S/CSe/c1-2 SPWXVDBGIFDREP-UHFFFAOYSA-N [C]=[Se]  
16674183 CSe+ Carbon monoselenide cation InChI=1S/CSe/c1-2/q+1 YVWYREXOXRZPAD-UHFFFAOYSA-N [C+]=[Se]  
12185170 Se2- selenium dimer anion InChI=1S/Se2/c1-2/q-1 DQTJTQYKOMVIHU-UHFFFAOYSA-N [Se-]=[Se]  
12185170 Se2 Selenium diatomic InChI=1S/Se2/c1-2 XIMIGUBYDJDCKI-UHFFFAOYSA-N [Se]=[Se]  
12185170 Se2+ selenium dimer cation InChI=1S/Se2/c1-2/q+1 VPTDTTKFVJBMIM-UHFFFAOYSA-N [Se+]=[Se]  
12640890 SeO- selenium monoxide anion InChI=1S/OSe/c1-2/q-1 NZTLOYGFDFZXQP-UHFFFAOYSA-N [Se][O-]  
12640890 SeO- selenium monoxide anion InChI=1S/HOSe/c1-2/h1H/p-1 VQNPRYUMHLOITA-UHFFFAOYSA-M [Se][O-]  
12640890 SeO Selenium monoxide InChI=1S/OSe/c1-2 ZIJTYIRGFVHPHZ-UHFFFAOYSA-N [Se]=O  
12640890 SeO+ selenium monoxide cation InChI=1S/OSe/c1-2/q+1 HEURKVUSRFQPCK-UHFFFAOYSA-N [Se+]=O  
7446346 SeS- selenium monosulfide anion InChI=1S/SSe/c1-2/q-1 MZYYCIPFRAZGGN-UHFFFAOYSA-N [Se-][S]  
7446346 SeS Selenium monosulfide InChI=1S/SSe/c1-2 VIDTVPHHDGRGAF-UHFFFAOYSA-N [Se]=S   Selenium sulphide; Sulfur selenide; selenium monosulfide
7446346 SeS+ selenium monosulfide cation InChI=1S/SSe/c1-2/q+1 ZQJXAKCXZFQKHJ-UHFFFAOYSA-N [Se][S+]  
204 CH3SeH Methane selenol InChI=1S/CH4Se/c1-2/h2H,1H3 APKHDKJWSHYLEU-UHFFFAOYSA-N C[Se]  
16846712 SeF Selenium monofluoride InChI=1S/FSe/c1-2 MWHREXSRHFCLNE-UHFFFAOYSA-N [Se]F  
19961296 BBr Boron monobromide InChI=1S/BBr/c1-2 YXCOLLAIMXVWPV-UHFFFAOYSA-N [B]Br  
13967298 NBr nitrogen monobromide InChI=1S/BrN/c1-2 YFQFTOCCYRNGIY-UHFFFAOYSA-N [N]Br   Bromoimidogen
13863417 BrCl- bromine chloride anion InChI=1S/BrCl/c1-2/q-1 BJSZBOOCXFXLAH-UHFFFAOYSA-N Br[Cl-]  
13863417 BrCl Bromine monochloride InChI=1S/BrCl/c1-2 CODNYICXDISAEA-UHFFFAOYSA-N BrCl   Bromine chloride; Bromochloride
13863417 BrCl+ bromine chloride cation InChI=1S/BrCl/c1-2/q+1 XNOJEOTZZFCNFM-UHFFFAOYSA-N Br[Cl+]  
13863597 BrF- bromine fluoride anion InChI=1S/BrF/c1-2/q-1 BSQMZVMUMQTUFY-UHFFFAOYSA-N Br[F-]  
13863597 BrF Bromine monofluoride InChI=1S/BrF/c1-2 MZJUGRUTVANEDW-UHFFFAOYSA-N BrF   Bromine fluoride
13863597 BrF+ bromine fluoride cation InChI=1S/BrF/c1-2/q+1 LFJOEVNIBINABS-UHFFFAOYSA-N [Br+]F  
15656196 BrO- Bromine monoxide anion InChI=1S/BrO/c1-2/q-1 JGJLWPGRMCADHB-UHFFFAOYSA-N Br[O-]  
15656196 BrO Bromine monoxide InChI=1S/BrO/c1-2 FMSOWMGJJIHFTQ-UHFFFAOYSA-N Br[O]  
7550358 LiBr- lithium bromide cation InChI=1S/BrH.Li/h1H;/p-1 VJHXXNYZXFPCGL-UHFFFAOYSA-M [Li][Br-]  
7550358 LiBr Lithium Bromide InChI=1S/BrH.Li/h1H;/q;+1/p-1 AMXOYNBUYSYVKV-UHFFFAOYSA-M [Li]Br  
7550358 LiBr+ lithium bromide anion InChI=1S/BrH.Li/h1H;/q;+2/p-1 IIIODQJJWFGNMN-UHFFFAOYSA-M [Li+]Br  
7647156 NaBr- sodium bromide anion InChI=1S/BrH.Na/h1H;/p-1 BXBUVIPNRGDTNE-UHFFFAOYSA-M [Na][Br-]  
7647156 NaBr Sodium Bromide InChI=1S/BrH.Na/h1H;/q;+1/p-1 JHJLBTNAGRQEKS-UHFFFAOYSA-M [Na]Br  
7647156 NaBr+ sodium bromide cation InChI=1S/BrH.Na/h1H;/q;+2/p-1 ASVMUXWJKLXQQD-UHFFFAOYSA-M [Na+]Br  
7726956 Br2- bromine diatomic anion InChI=1S/Br2/c1-2/q-1 LTDXHAFASXANOM-UHFFFAOYSA-N [Br-]Br  
7726956 Br2 Bromine diatomic InChI=1S/Br2/c1-2 GDTBXPJZTBHREO-UHFFFAOYSA-N BrBr   UN 1744; Dibromine; Broom; Brome; Bromo; Brom
7726956 Br2+ bromine diatomic cation InChI=1S/Br2/c1-2/q+1 YZABTPRDHYVJNU-UHFFFAOYSA-N [Br+]Br  
7758023 KBr Potassium Bromide InChI=1S/BrH.K/h1H;/q;+1/p-1 IOLCXVTUBQKXJR-UHFFFAOYSA-M [K]Br  
17141285 CHBr bromomethylene InChI=1S/CHBr/c1-2/h1H PRCFIJGWTCBHPP-UHFFFAOYSA-N [CH]Br  
13517118 HOBr Hypobromous acid InChI=1S/BrHO/c1-2/h2H CUILPNURFADTPE-UHFFFAOYSA-N BrO  
13517118 HOBr+ Hypobromous acid cation InChI=1S/BrHO/c1-2/h2H/q+1 XYOOZIOGTBYZIU-UHFFFAOYSA-N O[Br+]  
16519974 CH2Br bromomethyl radical InChI=1S/CH2Br/c1-2/h1H2 AOJDZKCUAATBGE-UHFFFAOYSA-N [CH2]Br  
6806866 CH2Cl chloromethyl radical InChI=1S/CH2Cl/c1-2/h1H2 WBLIXGSTEMXDSM-UHFFFAOYSA-N [CH2]Cl  
6806866 CH2Cl chloromethyl radical InChI=1S/CH2Cl/c1-2/h1H2 WBLIXGSTEMXDSM-UHFFFAOYSA-N [CH2]Cl  
74839 CH3Br methyl bromide InChI=1S/CH3Br/c1-2/h1H3 GZUXJHMPEANEGY-UHFFFAOYSA-N CBr   Embafume; Halon 1001; Methane, bromo-; Curafume; Monobromomethane; Methylbromid; Bromomethane
7789335 IBr Iodine monobromide InChI=1S/BrI/c1-2 CBEQRNSPHCCXSH-UHFFFAOYSA-N IBr  
7790990 ICl Iodine monochloride InChI=1S/ClI/c1-2 QZRGKCOWNLSUDK-UHFFFAOYSA-N ICl  
7553562 I2 Iodine diatomic InChI=1S/I2/c1-2 PNDPGZBMCMUPRI-UHFFFAOYSA-N II  
7553562 I2+ Iodine diatomic cation InChI=1S/I2/c1-2/q+1 GWDXVHOURQOCIJ-UHFFFAOYSA-N I[I+]  
13873842 IF Iodine monofluoride InChI=1S/FI/c1-2 PDJAZCSYYQODQF-UHFFFAOYSA-N IF  
74884 CH3I methyl iodide InChI=1S/CH3I/c1-2/h1H3 INQOMBQAUSQDDS-UHFFFAOYSA-N CI   Methane, iodo-; Iodomethane; Halon 10001; UN 2644; Monoiodomethane
12596473 Li3 Lithium trimer InChI=1S/3Li FUXWSNBUHAEWQU-UHFFFAOYSA-N [Li][Li][Li]  
12596473 Li3+ Lithium trimer cation InChI=1S/3Li/q;;+1 QYWCDVKQVLEPEA-UHFFFAOYSA-N [Li+]1[Li][Li]1  
12075353 C3 carbon trimer InChI=1S/C3/c1-3-2 NVLRFXKSQQPKAD-UHFFFAOYSA-N [C]=C=[C]  
12075353 C3 carbon trimer InChI=1S/C3/c1-3-2 NVLRFXKSQQPKAD-UHFFFAOYSA-N [C]=C=[C]  
12075353 C3+ carbon trimer cation InChI=1S/C3/c1-3-2/q+1 PNCCOGRYBZMOKI-UHFFFAOYSA-N [C]=[C+]=[C]  
12075353 C3+ carbon trimer cation InChI=1S/C3/c1-3-2/q+1 PNCCOGRYBZMOKI-UHFFFAOYSA-N [C]=[C+]=[C]  
9000220 C3H3 cyclopropenyl radical 1S/C3H3/c1-2-3-1/h1-3H [CH]1C=C1  
9000220 C3H3+ cyclopropenyl cation InChI=1S/C3H3/c1-2-3-1/h1-3H/q+1 IPKCFGQXHZKYLH-UHFFFAOYSA-N C1=C[CH+]1  
2932787 C3H3- Propargyl anion InChI=1S/C3H3/c1-3-2/h1H,2H2/q-1 XPVBHDCWRJTAOG-UHFFFAOYSA-N C#C[CH2-]  
2932787 C3H3- Propargyl anion InChI=1S/C3H3/c1-3-2/h1H,2H2/q-1 XPVBHDCWRJTAOG-UHFFFAOYSA-N C#C[CH2-]  
2932787 C3H3 Propargyl radical InChI=1S/C3H3/c1-3-2/h1H,2H2 DITHIFQMPPCBCU-UHFFFAOYSA-N C#C[CH2]   Prop-1-yn-3-yl radical; Propargyl radical; propargyl
2932787 C3H3+ Propargyl cation InChI=1S/C3H3/c1-3-2/h1H,2H2/q+1 XWSPZAXIQPESSO-UHFFFAOYSA-N C#C[CH2+]  
2781853 C3H4 cyclopropene InChI=1S/C3H4/c1-2-3-1/h1-2H,3H2 OOXWYYGXTJLWHA-UHFFFAOYSA-N C1=CC1   Cyclopropene
74997 CH3CCH propyne InChI=1S/C3H4/c1-3-2/h1H,2H3 MWWATHDPGQKSAR-UHFFFAOYSA-N CC#C   1-Propyne; Acetylene, methyl-; Allylene; Methylacetylene; Propine; Propyne; prop-1-yne
463490 CH2CCH2 allene InChI=1S/C3H4/c1-3-2/h1-2H2 IYABWNGZIDDRAK-UHFFFAOYSA-N C=C=C   1,2-Propadiene; Allene; Dimethylenemethane; Propa-1,2-diene; Propadiene; Propadiene, inhibited; sym-Allylene; UN 2200
6067681 CH3CHCH 1-propenyl radical InChI=1S/C3H5/c1-3-2/h1,3H,2H3 ZLRGTQBGRLOXCT-UHFFFAOYSA-N [CH]=CC  
1981802 C3H5 Allyl radical InChI=1S/C3H5/c1-3-2/h3H,1-2H2 RMRFFCXPLWYOOY-UHFFFAOYSA-N C=C[CH2]   Allyl radical; allyl
1981802 C3H5 Allyl radical InChI=1S/C3H5/c1-3-2/h3H,1-2H2 RMRFFCXPLWYOOY-UHFFFAOYSA-N C=C[CH2]   Allyl radical; allyl
1981802 C3H5+ Allyl cation InChI=1S/C3H5/c1-3-2/h3H,1-2H2/q+1 WPKVKNZNPQRHOD-UHFFFAOYSA-N C=C[CH2+]  
115071 CH2CHCH3 Propene InChI=1S/C3H6/c1-3-2/h3H,1H2,2H3 QQONPFPTGQHPMA-UHFFFAOYSA-N C=CC   1-Propene; 1-Propylene; Methylethene; Methylethylene; NCI-C50077; Propene; Propylene; UN 1077; UN 1075; prop-1-ene
75194 C3H6 Cyclopropane InChI=1S/C3H6/c1-2-3-1/h1-3H2 LVZWSLJZHVFIQJ-UHFFFAOYSA-N C1CC1   Cyclopropane; UN 1027; Trimethylene; Trimethylene (cyclic)
2025550 C3H7 Isopropyl radical InChI=1S/C3H7/c1-3-2/h3H,1-2H3 HNUALPPJLMYHDK-UHFFFAOYSA-N C[CH]C   iso-C3H7; Isopropyl radical; propyl; propan-2-yl
2143615 C3H7 n-Propyl radical InChI=1S/C3H7/c1-3-2/h1,3H2,2H3 OCBFFGCSTGGPSQ-UHFFFAOYSA-N [CH2]CC   n-C3H7; n-Propyl radical; propyl; propan-1-yl
74986 C3H8 Propane InChI=1S/C3H8/c1-3-2/h3H2,1-2H3 ATUOYWHBWRKTHZ-UHFFFAOYSA-N CCC   Dimethylmethane; Freon 290; Liquefied petroleum gas; Lpg; n-Propane; Propane; Propyl hydride; R 290; UN 1075; UN 1978
1884646 NCN NCN InChI=1S/CN2/c2-1-3 NFKMPKOGCRBAJF-UHFFFAOYSA-N [N]=C=[N]  
2408368 LiCN lithium cyanide InChI=1S/CN.Li/c1-2; KRPAPDCTWMTYHU-UHFFFAOYSA-N [Li]C#N  
2408368 LiCN lithium cyanide InChI=1S/CN.Li/c1-2; KRPAPDCTWMTYHU-UHFFFAOYSA-N [Li]C#N  
2408368 LiCN lithium cyanide InChI=1S/CN.Li/c1-2; KRPAPDCTWMTYHU-UHFFFAOYSA-N [C]#[N][Li]  
12596600 N3- azide anion InChI=1S/N3/c1-3-2/q-1 IVRMZWNICZWHMI-UHFFFAOYSA-N [N][N-][N]   azide
12596600 N3 azide radical InChI=1S/N3/c1-3-2 DUAJIKVIRGATIW-UHFFFAOYSA-N [N]=[N+]=[N-]  
12596600 N3+ azide cation InChI=1S/N3/c1-3-2/q+1 QGBUGMRRICCMFI-UHFFFAOYSA-N [N]=[N+]=[N]  
253308702 CN2 3H-Diazirin-3-ylidene InChI=1S/CN2/c1-2-3-1 NHKSYIUFCMYMCT-UHFFFAOYSA-N [C]1N=N1  
2612626 HCCN cyanomethylene InChI=1S/C2HN/c1-2-3/h1H SZICEGNEOSKVLO-UHFFFAOYSA-N [CH]C#N  
2612626 HCCN cyanomethylene InChI=1S/C2HN/c1-2-3/h1H SZICEGNEOSKVLO-UHFFFAOYSA-N [CH]C#N  
7782798 HN3 hydrogen azide InChI=1S/HN3/c1-3-2/h1H JUINSXZKUKVTMD-UHFFFAOYSA-N N=[N+]=[N-]   hydrozoic acid; azoimide; diazoimide; triazoic acid; hydronitric acid; hydrogen azide
151519 HNCNH diiminomethane InChI=1S/CH2N2/c2-1-3/h2-3H VPKDCDLSJZCGKE-UHFFFAOYSA-N N=C=N  
157222 CH2NN diazirine InChI=1S/CH2N2/c1-2-3-1/h1H2 GKVDXUXIAHWQIK-UHFFFAOYSA-N N1N=C1   3H-Diazirine
420042 NH2CN cyanamide InChI=1S/CH2N2/c2-1-3/h2H2 XZMCDFZZKTWFGF-UHFFFAOYSA-N NC#N   carbamonitrile; Amidocyanogen; Carbimide; Cyanoamine; Cyanogen nitride; Cyanogenamide; Hydrogen cyanamide; cyanamide
420042 NH2CN cyanamide InChI=1S/CH2N2/c2-1-3/h2H2 XZMCDFZZKTWFGF-UHFFFAOYSA-N NC#N   carbamonitrile; Amidocyanogen; Carbimide; Cyanoamine; Cyanogen nitride; Cyanogenamide; Hydrogen cyanamide; cyanamide
334883 CH2NN diazomethane InChI=1S/CH2N2/c1-3-2/h1H2 YXHKONLOYHBTNS-UHFFFAOYSA-N C=[N+]=[N-]  
593759 CH3NC methyl isocyanide InChI=1S/C2H3N/c1-3-2/h1H3 ZRKSVHFXTRFQFL-UHFFFAOYSA-N C[N+]#[C-]   Methane, isocyano-; isocyanomethane; Methyl isonitrile
75058 CH3CN- acetonitrile anion InChI=1S/C2H3N/c1-2-3/h1H3/q-1 WPBBMPWLVTVFOO-UHFFFAOYSA-N [CH3-]C#N  
75058 CH3CN- acetonitrile anion InChI=1S/C2H3N/c1-2-3/h1H3/q-1 WPBBMPWLVTVFOO-UHFFFAOYSA-N [CH3-]C#N  
75058 CH3CN Acetonitrile InChI=1S/C2H3N/c1-2-3/h1H3 WEVYAHXRMPXWCK-UHFFFAOYSA-N CC#N   Acetonitril; Acetonitrile; Cyanomethane; Cyanure de methyl; Ethanenitrile; Ethyl nitrile; Methane, cyano-; Methanecarbonitrile; Methyl cyanide; Methylkyanid; NA 1648; NCI-C60822; Rcra waste number U003; USAF ek-488; UN 1648
75058 CH3CN+ Acetonitrile cation InChI=1S/C2H3N/c1-2-3/h1H3/q+1 BARVRYCKQQYPDL-UHFFFAOYSA-N C[C]#[N+]  
75058 CH3CN+ Acetonitrile cation InChI=1S/C2H3N/c1-2-3/h1H3/q+1 BARVRYCKQQYPDL-UHFFFAOYSA-N C[C]#[N+]  
9000800 NCNH3+ Cyanamide, protonated InChI=1S/CH2N2/c2-1-3/h2H2/p+1 N#C[NH3+]  
28445332 CH3CHN methylmethaniminyl radical InChI=1S/C2H4N/c1-2-3/h2H,1H3 IBGMUOPBPGVUMD-UHFFFAOYSA-N CC=[N]  
50614034 CH2CHNH vinylazine InChI=1S/C2H4N/c1-2-3/h2-3H,1H2 NWMFLNMQDRCAOB-UHFFFAOYSA-N C=C[NH]   vinyl-@lambda;2-azane; 2@lambda;3-ethan-1-imine
50614034 CH2CHNH vinylazine InChI=1S/C2H4N/c1-2-3/h2-3H,1H2 NWMFLNMQDRCAOB-UHFFFAOYSA-N C=C[NH]   vinyl-@lambda;2-azane; 2@lambda;3-ethan-1-imine
10000 NHCHNH2 aminomethanimine InChI=1S/CH4N2/c2-1-3/h1H,(H3,2,3) PNKUSGQVOMIXLU-UHFFFAOYSA-N NC=N  
593679 CH2CHNH2 aminoethene InChI=1S/C2H5N/c1-2-3/h2H,1,3H2 UYMKPFRHYYNDTL-UHFFFAOYSA-N C=CN   Vinylamine; Aminoethylene; Ethenamine; Ethylenamine; Ethyleneamine
151564 C2H5N Aziridine InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2 NOWKCMXCCJGMRR-UHFFFAOYSA-N N1CC1   1H-Azirine, dihydro-; Aethylenimin; Aminoethylene; Azacyclopropane; Aziran; Azirane; Aziridin; Aziridine; Dihydro-1H-azirine; Dihydroazirene; Dimethyleneimine; Dimethylenimine; EI; ENT-50324; Ethirydine; Ethyleenimine; Ethylene imine, inhibited; Ethyleneimine; Ethylenimine; Ethylimine; Etilenimina; Rcra waste number P054; TL 337; UN 1185
1761677 CH2NCH3 N-methylmethanimine InChI=1S/C2H5N/c1-3-2/h1H2,2H3 NYVSDPNXBIEFPW-UHFFFAOYSA-N C=NC   2-Azapropene; N-methylenemethanamine
20729413 CH3CHNH ethanimine InChI=1S/C2H5N/c1-2-3/h2-3H,1H3 MPAYEWNVIPXRDP-UHFFFAOYSA-N CC=N   Acetaldimine; ethanimine
20729413 CH3CHNH ethanimine InChI=1S/C2H5N/c1-2-3/h2-3H,1H3 MPAYEWNVIPXRDP-UHFFFAOYSA-N CC=N   Acetaldimine; ethanimine
9000909 C2H5NH+ Protonated Aziridine InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2/p+1 [NH2+]1CC1  
2372885 NH2CH2NH2 diaminomethane InChI=1S/CH6N2/c2-1-3/h1-3H2 RTWNYYOXLSILQN-UHFFFAOYSA-N NCN  
2372885 NH2CH2NH2 diaminomethane InChI=1S/CH6N2/c2-1-3/h1-3H2 RTWNYYOXLSILQN-UHFFFAOYSA-N NCN  
124403 CH3NHCH3 Dimethylamine InChI=1S/C2H7N/c1-3-2/h3H,1-2H3 ROSDSFDQCJNGOL-UHFFFAOYSA-N CNC   Dimethylamine; DMA; Methanamine, N-methyl-; N-Methylmethanamine; Rcra waste number U092; UN 1032; UN 1160; N-Methylmethanamine
75047 CH3CH2NH2 Ethylamine InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3 QUSNBJAOOMFDIB-UHFFFAOYSA-N CCN   1-Aminoethane; Aethylamine; Aminoethane; Ethanamine; Ethylamine; Etilamina; Etyloamina; Monoethylamine; UN 1036; UN 2270
145384527 (CH3)2NH2+ dimethylammonium cation InChI=1S/C2H7N/c1-3-2/h3H,1-2H3/p+1 C[NH2+]C   Dimethyl amine, protonated
848779204 CH3CH2NH3+ ethylamine, protonated InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3/p+1 [NH3+]CC   ethylammonium cation
82267150 CNO- fulminate InChI=1S/CHNO/c1-2-3/h3H/p-1 OTXBWGUYZNKPMG-UHFFFAOYSA-M [C]=N[O-]  
82267150 CNO- fulminate InChI=1S/CNO/c1-2-3/q-1 USXDFAGDIOXNML-UHFFFAOYSA-N [O-][N+]#[C-]  
10028156 O3- Ozone anion InChI=1S/O3/c1-3-2/q-1 QOHPWKJMIUDENU-UHFFFAOYSA-N [O]O[O-]  
10028156 O3- Ozone anion InChI=1S/O3/c1-3-2/q-1 QOHPWKJMIUDENU-UHFFFAOYSA-N [O]O[O-]  
10028156 O3 Ozone InChI=1S/O3/c1-3-2 CBENFWSGALASAD-UHFFFAOYSA-N O=[O+][O-]   Ozon; Ozone; Triatomic oxygen; trioxidane
10028156 O3+ Ozone cation InChI=1S/O3/c1-3-2/q+1 GBTYLRHVJVWXAA-UHFFFAOYSA-N [O][O+]=O  
10024972 N2O- Nitrous oxide anion InChI=1S/N2O/c1-2-3/q-1 NLBWPJGNGYHCQO-UHFFFAOYSA-N [N-]N=O  
10024972 N2O- Nitrous oxide anion InChI=1S/HN2O/c1-2-3/h3H/p-1 MLBDTVVZLMQMLJ-UHFFFAOYSA-M  
10024972 N2O Nitrous oxide InChI=1S/N2O/c1-2-3 GQPLMRYTRLFLPF-UHFFFAOYSA-N [N]N=O   Dinitrogen monoxide; Dinitrogen oxide; Factitious air; Hyponitrous acid anhydride; Laughing gas; Nitrogen Monoxide; Nitrogen oxide; Nitrogen oxide (N2O); Nitrous Oxide; UN 1070; UN 2201
10024972 N2O+ Nitrous oxide cation InChI=1S/N2O/c1-2-3/q+1 BEZCXZPDDIVIRI-UHFFFAOYSA-N [N]=[N+]=O  
10102440 NO2- Nitrogen dioxide anion InChI=1S/HNO2/c2-1-3/h(H,2,3)/p-1 IOVCWXUNBOPUCH-UHFFFAOYSA-M [O-]N=O  
10102440 NO2 Nitrogen dioxide InChI=1S/NO2/c2-1-3 JCXJVPUVTGWSNB-UHFFFAOYSA-N O=N=O   Azote; Azoto; NA 1067; Nitrito; Nitro; Nitrogen dioxide; Nitrogen oxide; Nitrogen oxide (NO2); Nitrogen peroxide; Rcra waste number P078; Stickstoffdioxid; Stikstofdioxyde; UN 1067
10102440 NO2+ Nitrogen dioxide cation InChI=1S/NO2/c2-1-3/q+1 OMBRFUXPXNIUCZ-UHFFFAOYSA-N O=[N+]=O  
12057248 Li2O dilithium oxide InChI=1S/2Li.O XZIUWXMPQBQHMC-UHFFFAOYSA-N [Li]O[Li]   lithium oxide
12057248 Li2O dilithium oxide InChI=1/2Li.O/rLi2O/c1-3-2 XZIUWXMPQBQHMC-GBJCHMORNA-N [Li]O[Li]   lithium oxide
12057248 Li2O+ dilithium oxide cation InChI=1S/2Li.O/q;+1; YLMIOLAGPPQQMI-UHFFFAOYSA-N [Li][O+][Li]  
12057248 Li2O+ dilithium oxide cation InChI=1/2Li.O/q;+1;/rLi2O/c1-3-2/q+1 YLMIOLAGPPQQMI-AKZOVUJHNA-N [Li][O+][Li]  
12071237 CCO Dicarbon monoxide InChI=1S/C2O/c1-2-3 VILAVOFMIJHSJA-UHFFFAOYSA-N [C]=C=O  
22400266 NCO- cyanate InChI=1S/CHNO/c2-1-3/h3H/p-1 XLJMAIOERFSOGZ-UHFFFAOYSA-M N#C[O-]   cyanate; isocyanate; cyanato anion; isocyanato anion
22400266 NCO isocyanato radical InChI=1S/CNO/c2-1-3 HKKDKUMUWRTAIA-UHFFFAOYSA-N [N]=C=O  
13840885 BO2- Boron dioxide anion InChI=1S/BO2/c2-1-3/q-1 VDLZIANVOYDKFH-UHFFFAOYSA-N O=[B-]=O  
13840885 BO2- Boron dioxide anion InChI=1S/BO2/c2-1-3/q-1 VDLZIANVOYDKFH-UHFFFAOYSA-N  
13840885 BO2 Boron dioxide InChI=1S/BO2/c2-1-3 IBNAUDPYZAZFLM-UHFFFAOYSA-N O=B=O   Boron oxide
13840885 BO2+ Boron dioxide cation InChI=1S/BO2/c2-1-3/q+1 ZVMRFIDMDQSHBG-UHFFFAOYSA-N [O][B+][O]  
124389 CO2- Carbon dioxide anion InChI=1S/CO2/c2-1-3/q-1 SSODQXRGMVULMF-UHFFFAOYSA-N O=[C-][O]  
124389 CO2- Carbon dioxide anion InChI=1S/CO2/c2-1-3/q-1 SSODQXRGMVULMF-UHFFFAOYSA-N O=[C-][O]  
124389 CO2 Carbon dioxide InChI=1S/CO2/c2-1-3 CURLTUGMZLYLDI-UHFFFAOYSA-N O=C=O   Anhydride carbonique; Carbon dioxide; Carbon oxide (CO2); Carbonic acid, gas; Carbonic anhydride; Carbonice; Dry ice; Kohlendioxyd; Kohlensaure; UN 2187; UN 1013; UN 1845
124389 CO2+ Carbon dioxide cation InChI=1S/CO2/c2-1-3/q+1 PCDPTONYKSNEJX-UHFFFAOYSA-N [O][C+]=O  
124389 CO2+ Carbon dioxide cation InChI=1S/CO2/c2-1-3/q+1 PCDPTONYKSNEJX-UHFFFAOYSA-N [O][C+]=O  
420053 HOCN cyanic acid InChI=1S/CHNO/c2-1-3/h3H XLJMAIOERFSOGZ-UHFFFAOYSA-N OC#N  
506854 HCNO fulminic acid InChI=1S/CHNO/c1-2-3/h1H UXKUODQYLDZXDL-UHFFFAOYSA-N O[N+]#[C-]   Hydrogen cyanide N-oxide
506854 HCNO fulminic acid InChI=1S/CHNO/c1-2-3/h1H UXKUODQYLDZXDL-UHFFFAOYSA-N O[N+]#[C-]   Hydrogen cyanide N-oxide
75138 HNCO Isocyanic acid InChI=1S/CHNO/c2-1-3/h2H OWIKHYCFFJSOEH-UHFFFAOYSA-N N=C=O   Carbimide; Hydrogen isocyanate; Isocyanic acid; nitrosyl hydride
2564865 HOCO Hydrocarboxyl radical InChI=1S/CHO2/c2-1-3/h(H,2,3) ORTFAQDWJHRMNX-UHFFFAOYSA-N O[C]=O  
2564865 HOCO Hydrocarboxyl radical InChI=1S/CHO2/c2-1-3/h(H,2,3) ORTFAQDWJHRMNX-UHFFFAOYSA-N O[C]=O  
2564865 HOCO+ Hydrocarboxyl cation InChI=1S/CHO2/c2-1-3/h(H,2,3)/q+1 CLJFDRKGHKJAKZ-UHFFFAOYSA-N O[C+]=O   protonated carbon dioxide; hydroxy(oxo)methylium
2564865 HOCO+ Hydrocarboxyl cation InChI=1/CHO2/c2-1-3/h(H,2,3)/q+1/f/h2H CLJFDRKGHKJAKZ-QEZKKOIZNA-N   protonated carbon dioxide; hydroxy(oxo)methylium
7782776 HNO2 Nitrous acid InChI=1S/HNO2/c2-1-3/h(H,2,3) IOVCWXUNBOPUCH-UHFFFAOYSA-N ON=O   Kyselina dusite; Nitrosyl hydroxide; Nitrous acid; Nitrous acid, trans
7782776 HNO2+ nitrous acid cation InChI=1S/HNO2/c2-1-3/h1H/q+1 SDANASVQBIOOQZ-UHFFFAOYSA-N [O][NH+][O]  
9000392 HCOO formate neutral radical InChI=1S/CHO2/c2-1-3/h1H JRCLCXAVSVCEQC-UHFFFAOYSA-N O=C[O]  
12311976 HCO2- formate anion InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)/p-1 BDAGIHXWWSANSR-UHFFFAOYSA-M O=C[O-]  
51095159 HCCO ketenyl radical InChI=1S/C2HO/c1-2-3/h1H QEJQAPYSVNHDJF-UHFFFAOYSA-N [CH]=C=O   Ethynyloxy radical
51095159 HCCO ketenyl radical InChI=1S/C2HO/c1-2-3/h1H QEJQAPYSVNHDJF-UHFFFAOYSA-N [CH]=C=O   Ethynyloxy radical
35576911 NH2NO Nitrosamide InChI=1S/H2N2O/c1-2-3/h(H2,1,3) XKLJHFLUAHKGGU-UHFFFAOYSA-N O=NN   Nitrosamine; N-?Nitrosamine; Nitrous amide; Nitroxylamide
32038792 HCCOH ethynol InChI=1S/C2H2O/c1-2-3/h1,3H QFXZANXYUCUTQH-UHFFFAOYSA-N C#CO  
14699991 H2O3 Hydrogen trioxide InChI=1S/H2O3/c1-3-2/h1-2H JSPLKZUTYZBBKA-UHFFFAOYSA-N OOO   trioxidane
64186 HCOOH Formic acid InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3) BDAGIHXWWSANSR-UHFFFAOYSA-N OC=O   Acide formique; Acido formico; Add-F; Ameisensaeure; Aminic acid; Bilorin; Collo-Bueglatt; Collo-Didax; Formic acid; Formic acid, solution; Formira; Formisoton; Formylic acid; Hydrogen carboxylic acid; Kwas metaniowy; Kyselina mravenci; Methanoic acid; Mierenzuur; Myrmicyl; Rcra waste number U123; UN 1779
463514 CH2CO Ketene InChI=1S/C2H2O/c1-2-3/h1H2 CCGKOQOJPYTBIH-UHFFFAOYSA-N C=C=O   Carbomethene; Ethenone; Ketene; Keto-ethylene; Methylene ketene
463514 CH2CO+ Ketene cation InChI=1S/C2H2O/c1-2-3/h1H2/q+1 UJTMLNARSPORHR-UHFFFAOYSA-N C=C=[O+]  
157266 CH2O2 Dioxirane InChI=1S/CH2O2/c1-2-3-1/h1H2 ASQQEOXYFGEFKQ-UHFFFAOYSA-N O1OC1  
157186 C2H2O Oxirene InChI=1S/C2H2O/c1-2-3-1/h1-2H BJEYNNFDAPPGST-UHFFFAOYSA-N O1C=C1  
75127 CHONH2 formamide InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3) ZHNUHDYFZUAESO-UHFFFAOYSA-N NC=O   Amid kyseliny mravenci; Formimidic acid; formamide; Formimidic acid; Methanamide; Amid kyseliny mravenci; Methanamide; Carbamaldehyde; Carbamaldehyde
75127 CHONH2 formamide InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2H2 ZHNUHDYFZUAESO-RZDQGJFANA-N   Amid kyseliny mravenci; Formimidic acid; formamide; Formimidic acid; Methanamide; Amid kyseliny mravenci; Methanamide; Carbamaldehyde; Carbamaldehyde
75127 CHONH2 formamide InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3) ZHNUHDYFZUAESO-UHFFFAOYSA-N NC=O   Amid kyseliny mravenci; Formimidic acid; formamide; Formimidic acid; Methanamide; Amid kyseliny mravenci; Methanamide; Carbamaldehyde; Carbamaldehyde
75172 CH2NOH formaldoxime InChI=1S/CH3NO/c1-2-3/h3H,1H2 SQDFHQJTAWCFIB-UHFFFAOYSA-N C=NO   formaldehyde oxime
3170692 CH3CO- Acetyl anion InChI=1S/C2H3O/c1-2-3/h1H3/q-1 RRGZOQKPWJKLOE-UHFFFAOYSA-N C[C-][O]  
3170692 CH3CO Acetyl radical InChI=1S/C2H3O/c1-2-3/h1H3 TUCNEACPLKLKNU-UHFFFAOYSA-N O=[C]C   Acetyl radical; acetyl
3170692 CH3CO+ acetyl cation InChI=1S/C2H3O/c1-2-3/h1H3/q+1 TWAOQVMPIYQPKG-UHFFFAOYSA-N O=[C+]C  
6827265 CNOH3 1,2-oxaziridine InChI=1S/CH3NO/c1-2-3-1/h2H,1H2 SJGALSBBFTYSBA-UHFFFAOYSA-N C1NO1  
4400015 CH2CHO Vinyloxy radical InChI=1S/C2H3O/c1-2-3/h2H,1H2 FATAVLOOLIRUNA-UHFFFAOYSA-N [CH2]C=O  
2143580 CH3OO- methylperoxy anion InChI=1S/CH4O2/c1-3-2/h2H,1H3/p-1 MEUKEBNAABNAEX-UHFFFAOYSA-M CO[O-]  
2143580 CH3OO- methylperoxy anion InChI=1/CH4O2/c1-3-2/h2H,1H3/p-1/fCH3O2/h2h/q-1 MEUKEBNAABNAEX-ZAIKRNDUNA-M  
2143580 CH3OO- methylperoxy anion InChI=1S/CH4O2/c1-3-2/h2H,1H3/p-1 MEUKEBNAABNAEX-UHFFFAOYSA-M CO[O-]  
2143580 CH3OO methylperoxy radical InChI=1S/CH3O2/c1-3-2/h1H3 WTFNSXYULBQCQV-UHFFFAOYSA-N CO[O]   peroxymethyl; methylperoxy
2143580 CH3OO+ methylperoxy cation InChI=1S/CH3O2/c1-3-2/h1H3/q+1 HRUCYOXWRHWOMG-UHFFFAOYSA-N C[O+]=O  
2143580 CH3OO+ methylperoxy cation InChI=1S/CH3O2/c1-3-2/h1H3/q+1 HRUCYOXWRHWOMG-UHFFFAOYSA-N C[O+]=O  
865407 CH3NO nitrosomethane InChI=1S/CH3NO/c1-2-3/h1H3 IMHRONYAKYWGCC-UHFFFAOYSA-N CN=O  
13205442 BH3CO Borane carbonyl InChI=1S/CH3BO/c2-1-3/h2H3 ZJUVLBOEAXFSHP-UHFFFAOYSA-N [BH3-][C]=[O+]  
9000777 HOCHNH hydroxymethylimine InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3) ZHNUHDYFZUAESO-UHFFFAOYSA-N OC=N  
9000777 HOCHNH hydroxymethylimine InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2-3H/b2-1+ ZHNUHDYFZUAESO-ZGLFGPHZNA-N  
9000777 HOCHNH hydroxymethylimine InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3) ZHNUHDYFZUAESO-UHFFFAOYSA-N OC=N  
9000777 HOCHNH hydroxymethylimine InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2-3H/b2-1+ ZHNUHDYFZUAESO-ZGLFGPHZNA-N  
9000777 HOCHNH hydroxymethylimine InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3) ZHNUHDYFZUAESO-UHFFFAOYSA-N OC=N  
9000777 HOCHNH hydroxymethylimine InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2-3H/b2-1- ZHNUHDYFZUAESO-HEFLTZLYNA-N  
9000344 CH2OOH CH2OOH InChI=1S/CH3O2/c1-3-2/h2H,1H2 CIWKZUVHMBXKEZ-UHFFFAOYSA-N [CH2]C=O  
79723210 CH3BO Borane, methyloxo- InChI=1S/CH3BO/c1-2-3/h1H3 CB=O   Methyl(oxo)borane
422506716 CH2BOH hydroxy(methylene)borane InChI=1S/CH3BO/c1-2-3/h3H,1H2 C=BO  
9000770 H2CONH2+ protonated formamide InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)/p+1 ZHNUHDYFZUAESO-UHFFFAOYSA-O OC=[NH2+]  
9000770 H2CONH2+ protonated formamide InChI=1S/CH4NO/c2-1-3/h1,3H,2H2/q+1 QUOAGGNJAZUPJG-UHFFFAOYSA-N  
3031730 CH3OOH Methyl peroxide InChI=1S/CH4O2/c1-3-2/h2H,1H3 MEUKEBNAABNAEX-UHFFFAOYSA-N OOC   Hydroperoxide, methyl; methyl Hydroperoxide; hydroperoxymethane
75218 C2H4O Ethylene oxide InChI=1S/C2H4O/c1-2-3-1/h1-2H2 IAYPIBMASNFSPL-UHFFFAOYSA-N C1CO1   α,β-Oxidoethane; 1,2-Epoxyaethan; 1,2-Epoxyethane; Aethylenoxid; Amprolene; Anprolene; Anproline; Dihydrooxirene; Dimethylene oxide; E.O.; ENT-26263; Epoxyethane; Ethene oxide; Ethox; Ethyleenoxide; Ethylene oxide; ETO; Etylenu tlenek; FEMA No. 2433; Merpol; NCI-C50088; Oxacyclopropane; Oxane; Oxidoethane; Oxiraan; Oxiran; Oxirane; Oxirene, Dihydro-; Oxyfume; Oxyfume 12; Rcra waste number U115; Sterilizing gas ethylene oxide 100%; T-Gas; UN 1040; alpha,beta-Oxidoethane
75070 CH3CHO Acetaldehyde InChI=1S/C2H4O/c1-2-3/h2H,1H3 IKHGUXGNUITLKF-UHFFFAOYSA-N CC=O   Acetaldehyd; Acetaldehyde; Acetaldeyde; Acetic aldehyde; Acetylaldehyde; Aldehyde acetique; Aldeide acetica; Ethanal; Ethyl aldehyde; NCI-C56326; Octowy aldehyd; Rcra waste number U001; UN 1089
55 H2OH2CO water formaldehyde dimer InChI=1S/CH3O.H2O/c1-2;/h2H,1H2;1H2 WYLNZMAZETZTPE-UHFFFAOYSA-N O.C=O  
463570 CH2(OH)2 methanediol InChI=1S/CH4O2/c2-1-3/h2-3H,1H2 CKFGINPQOCXMAZ-UHFFFAOYSA-N OCO  
557755 CH2CHOH ethenol InChI=1S/C2H4O/c1-2-3/h2-3H,1H2 IMROMDMJAWUWLK-UHFFFAOYSA-N C=CO   Vinyl alcohol; Hydroxyethylene; ethenol
2348461 CH3CHOH 1-hydroxy-ethyl radical InChI=1S/C2H5O/c1-2-3/h2-3H,1H3 GAWIXWVDTYZWAW-UHFFFAOYSA-N C[CH]O   1-Hydroxyethyl; Hydroxyethyl radical; a-Hydroxyethyl
2154509 CH3CH2O Ethoxy radical InChI=1S/C2H5O/c1-2-3/h2H2,1H3 VOLGAXAGEUPBDM-UHFFFAOYSA-N CC[O]  
4422542 CH2CH2OH 2-hydroxy ethyl radical InChI=1S/C2H5O/c1-2-3/h3H,1-2H2 HVFGPIFTSJJAKK-UHFFFAOYSA-N OC[CH2]   ethanol-2-yl
4422542 CH2CH2OH 2-hydroxy ethyl radical InChI=1S/C2H5O/c1-2-3/h3H,1-2H2 HVFGPIFTSJJAKK-UHFFFAOYSA-N OC[CH2]   ethanol-2-yl
16520040 CH3OCH2 methoxymethyl radical InChI=1S/C2H5O/c1-3-2/h1H2,2H3 AFGPRWUFPLEMTF-UHFFFAOYSA-N CO[CH2]  
475503685 CH3CHOH+ acetaldehyde, protonated InChI=1S/C2H5O/c1-2-3/h2-3H,1H3/q+1 GVWBHEKHFYAXOH-UHFFFAOYSA-N C[CH+]O  
475503685 CH3CHOH+ acetaldehyde, protonated InChI=1S/C2H4O/c1-2-3/h2H,1H3/p+1 IKHGUXGNUITLKF-UHFFFAOYSA-O CC=[OH+]  
115106 CH3OCH3 Dimethyl ether InChI=1S/C2H6O/c1-3-2/h1-2H3 LCGLNKUTAGEVQW-UHFFFAOYSA-N COC   Dimethyl ether; Dimethyl oxide; Dymel A; Ether, dimethyl; Ether, methyl; Methane, oxybis-; Methoxymethane; Methyl ether; Oxybismethane; ether; Wood ether; UN 1033
77 H2OCH3OH water methanol dimer InChI=1S/CH4O.H2O/c1-2;/h2H,1H3;1H2 GBMDVOWEEQVZKZ-UHFFFAOYSA-N OC.O  
77 H2OCH3OH water methanol dimer InChI=1S/CH6O2/c1-3-4-2/h2-3H,1H3 NBQCBEISNPLSNO-UHFFFAOYSA-N  
88 CH3OHH2O methanol water dimer InChI=1S/CH4O.H2O/c1-2;/h2H,1H3;1H2 GBMDVOWEEQVZKZ-UHFFFAOYSA-N OC.O  
88 CH3OHH2O methanol water dimer InChI=1S/CH6O2/c1-3-4-2/h2H2,1H3 RLIANZSMIKXDSS-UHFFFAOYSA-N  
64175 CH3CH2OH Ethanol InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3 LFQSCWFLJHTTHZ-UHFFFAOYSA-N CCO   Absolute ethanol; Aethanol; Aethylalkohol; Alcare Hand Degermer; Alcohol; Alcool ethylique; Alcool etilico; Algrain; Alkohol; Alkoholu etylowego; Anhydrol; Cologne spirit; Denatured alcohol CD-10; Denatured alcohol CD-5; Denatured alcohol CD-5a; Denatured alcohol SD-1; Denatured alcohol SD-13a; Denatured alcohol SD-17; Denatured alcohol SD-23a; Denatured alcohol SD-28; Denatured alcohol SD-30; Denatured alcohol SD-39b; Denatured alcohol SD-39c; Denatured alcohol SD-3a; Denatured alcohol SD-40m; Denatured ethanol; Etanolo; Ethanol; Ethyl alc; Ethyl alcohol; Ethyl hydrate; Ethyl hydroxide; EtOH; Etylowy alkohol; Fermentation alcohol; Grain alcohol; Jaysol; Jaysol S; Methylcarbinol; Molasses alcohol; NCI-C03134; Potato alcohol; SD Alchol 23-hydrogen; SD alcohol 23-hydrogen; Spirits of wine; Spirt; Tecsol; Tecsol C; Thanol; UN 1170
3744078 NF2 Difluoroamino radical InChI=1S/F2N/c1-3-2 BBZREMAMWBDNHH-UHFFFAOYSA-N F[N]F   Difluoroamidogen; Difluoroamino radical
3744078 NF2+ Difluoroamino cation InChI=1S/F2N/c1-3-2/q+1 MRTSUKPKYZWSDW-UHFFFAOYSA-N F[N+]F  
2154598 CF2- Difluoromethylene anion InChI=1S/CF2/c2-1-3/q-1 AMBFVCAELNSIML-UHFFFAOYSA-N F[C-]F  
2154598 CF2 Difluoromethylene InChI=1S/CF2/c2-1-3 LTVOKYUPTHZZQH-UHFFFAOYSA-N F[C]F   Difluoromethylene
2154598 CF2+ Difluoromethylene cation InChI=1S/CF2/c2-1-3/q+1 GABNKAYPQUNMGY-UHFFFAOYSA-N F[C+]F  
1871245 FCO Carbonyl fluoride InChI=1S/CFO/c2-1-3 CJXGPJZUDUOZDX-UHFFFAOYSA-N F[C]=O  
1871245 FCO+ Carbonyl fluoride cation InChI=1S/CFO/c2-1-3/q+1 BCBJDTWSGXYIEB-UHFFFAOYSA-N F[C+][O]  
1495507 FCN Cyanogen fluoride InChI=1S/CFN/c2-1-3 CPPKAGUPTKIMNP-UHFFFAOYSA-N FC#N  
7783417 F2O Difluorine monoxide InChI=1S/F2O/c1-3-2 UJMWVICAENGCRF-UHFFFAOYSA-N FOF   Difluorine monooxide; Difluorine monoxide; Fluorine monoxide; Fluorine oxide; Oxydifluoride; Oxygen difluoride; Oxygen fluoride; Oxygen fluoride (OF2); UN 2190; hypofluorous anhydride
7789255 FNO Nitrosyl fluoride InChI=1S/FNO/c1-2-3 ZEIYBPGWHWECHV-UHFFFAOYSA-N O=NF   Nitrogen oxide fluoride; Nitrogen oxyfluoride; Nitrosyl fluoride
7787497 BeF2 Beryllium fluoride InChI=1S/Be.2FH/h;2*1H/q+2;;/p-2 JZKFIPKXQBZXMW-UHFFFAOYSA-L F[Be]F  
15499237 FO2 Dioxygen monofluoride InChI=1S/FO2/c1-3-2 GQRAHKRZRKCZPQ-UHFFFAOYSA-N FO[O]   Oxygen fluoride
25730998 F3- trifluoride anion InChI=1S/F2.FH/c1-2;/h;1H/p-1 IGFHKBDKODMYIU-UHFFFAOYSA-M FF.[F-]  
25730998 F3- trifluoride anion InChI=1S/F3/c1-3-2/q-1 YOJONUWAMPIOKB-UHFFFAOYSA-N FF.[F-]  
25730998 F3- trifluoride anion InChI=1S/F2.FH/c1-2;/h;1H/p-1 IGFHKBDKODMYIU-UHFFFAOYSA-M FF.[F-]  
13709836 BHF2 Difluoroborane InChI=1S/BF2H/c2-1-3/h1H LRZMJFRZMNWFKE-UHFFFAOYSA-N FBF   Difluoroborane
1493023 HFCO formyl fluoride InChI=1S/CHFO/c2-1-3/h1H NHGVZTMBVDFPHJ-UHFFFAOYSA-N O=CF  
1493023 HFCO+ formyl fluoride cation InChI=1S/CHFO/c2-1-3/h1H/q+1 PAJYIZZRXQZSJP-UHFFFAOYSA-N [O][CH+]F  
2670135 CHF2 difluoromethyl radical InChI=1S/CHF2/c2-1-3/h1H JNCMHMUGTWEVOZ-UHFFFAOYSA-N F[CH]F   Methyl radical, difluoro-
2713099 HCCF Fluoroacetylene InChI=1S/C2HF/c1-2-3/h1H IAWCIZWLKMTPLL-UHFFFAOYSA-N C#CF   Ethyne, fluoro-; Fluoroethyne; Monofluoroacetylene; Acetylene, fluoro-
2713099 HCCF+ fluoroacetylene cation InChI=1S/C2HF/c1-2-3/h1H/q+1 GLCHAECFVXVCHF-UHFFFAOYSA-N F[C]=[CH+]  
75105 CH2F2 Methane, difluoro- InChI=1S/CH2F2/c2-1-3/h1H2 RWRIWBAIICGTTQ-UHFFFAOYSA-N FCF   Carbon fluoride hydride (CF2H2); Difluoromethane; Freon 32; Genetron 32; Methane, difluoro-; Methylene difluoride; Methylene fluoride; R 32
75025 CH2CHF Ethene, fluoro- InChI=1S/C2H3F/c1-2-3/h2H,1H2 XUCNUKMRBVNAPB-UHFFFAOYSA-N FC=C   Ethene, fluoro-; Ethylene, fluoro-; Fluoroethene; Fluoroethylene; Monofluoroethylene; UN 1860; Vinyl fluoride, inhibited; Vinyl fluoride
75025 CH2CHF+ fluoroethene cation InChI=1S/C2H3F/c1-2-3/h2H,1H2/q+1 GXYYCSRGMIQABH-UHFFFAOYSA-N [CH2][CH+]F  
353366 C2H5F fluoroethane InChI=1S/C2H5F/c1-2-3/h2H2,1H3 UHCBBWUQDAVSMS-UHFFFAOYSA-N CCF   Ethyl fluoride; Ethane, fluoro-; Monofluoroethane; fluoroethane
143339 NaCN Sodium Cyanide InChI=1S/CN.Na/c1-2; RTVFYQXEHKQMKO-UHFFFAOYSA-N N#C[Na]  
143339 NaCN Sodium Cyanide InChI=1S/CN.Na/c1-2; RTVFYQXEHKQMKO-UHFFFAOYSA-N N#C[Na]  
1313593 Na2O disodium monoxide InChI=1S/2Na.O QVUYWFOHKOTLOB-UHFFFAOYNA-N [Na]O[Na]   Sodium oxide; Disodium oxide
1313593 Na2O disodium monoxide InChI=1S/2Na.O QVUYWFOHKOTLOB-UHFFFAOYNA-N [Na]O[Na]   Sodium oxide; Disodium oxide
124414 NaOCH3 Sodium methoxide InChI=1S/CH3O.Na/c1-2;/h1H3;/q-1;+1 WQDUMFSSJAZKTM-UHFFFAOYSA-N [Na]OC   sodium methanolate
1309428 Mg(OH)2 Magnesium dihydroxide InChI=1S/Mg.2H2O/h;2*1H2/q+2;;/p-2 VTHJTEIRLNZDEV-UHFFFAOYSA-L O[Mg]O  
1309428 Mg(OH)2 Magnesium dihydroxide InChI=1S/Mg.2H2O/h;2*1H2/q+2;;/p-2 VTHJTEIRLNZDEV-UHFFFAOYSA-L O[Mg]O  
7783406 MgF2 Magnesium fluoride InChI=1S/2FH.Mg/h2*1H;/q;;+2/p-2 ORUIBWPALBXDOA-UHFFFAOYSA-L F[Mg]F  
1111746 SiH2(CH3)2 dimethylsilane InChI=1S/C2H8Si/c1-3-2/h3H2,1-2H3 UBHZUDXTHNMNLD-UHFFFAOYSA-N C[SiH2]C  
7631869 SiO2 silicon dioxide InChI=1S/O2Si/c1-3-2 VYPSYNLAJGMNEJ-UHFFFAOYSA-N O=[Si]=O   Amorphous silica gel; Silica; Silicic anhydride; Silicon dioxide; Silicon oxide; Silicon(IV) oxide
1396660 SiF2 Silicon difluoride InChI=1S/F2Si/c1-3-2 MGNHOGAVECORPT-UHFFFAOYSA-N F[Si]F   Difluorosilylene; Silicon difluoride
1396660 SiF2+ Silicon difluoride cation InChI=1S/F2Si/c1-3-2/q+1 WPLNUGDSAZHARN-UHFFFAOYSA-N F[Si+]F  
12164975 PO2- Phosphorus dioxide anion InChI=1S/HO2P/c1-3-2/h(H,1,2)/p-1 GQZXNSPRSGFJLY-UHFFFAOYSA-M [O-]P=O  
12164975 PO2 Phosphorus dioxide InChI=1S/O2P/c1-3-2 CJDZTJNITSFKRE-UHFFFAOYSA-N O=[P]=O  
12164975 PO2+ Phosphorus dioxide cation InChI=1S/O2P/c1-3-2/q+1 JXHYXDDQABAXTQ-UHFFFAOYSA-N O=[P+]=O  
114584268 PPO PPO InChI=1S/OP2/c1-3-2 BUYIAIMTTAEIOB-UHFFFAOYSA-N [P-][P+]=O  
56400023 NNS Nitrogen sulfide InChI=1S/N2S/c1-2-3 OBISXEJSEGNNKL-UHFFFAOYSA-N [N-]=[N+]=S   Dinitrogen-N-sulfide; Nitrous sulfide
12136582 Li2S dilithium sulfide InChI=1S/2Li.S ZWDBUTFCWLVLCQ-UHFFFAOYSA-N [Li]S[Li]  
12136582 Li2S dilithium sulfide InChI=1S/2Li.S ZWDBUTFCWLVLCQ-UHFFFAOYSA-N [Li]S[Li]  
13759109 SiS2 Silicon disulfide InChI=1S/S2Si/c1-3-2 KHDSWONFYIAAPE-UHFFFAOYSA-N [S][Si][S]   silicon disulphide
12597034 S3- Sulfur trimer anion InChI=1S/HS3/c1-3-2/h1H/p-1 WMXWXNVGXOWZRJ-UHFFFAOYSA-M [S]S[S-]  
12597034 S3 Sulfur trimer InChI=1S/S3/c1-3-2 NVSDADJBGGUCLP-UHFFFAOYSA-N S=S=S  
12597034 S3+ Sulfur trimer cation InChI=1S/S3/c1-3-2/q+1 YKEMVFDZPHZNKQ-UHFFFAOYSA-N [S][S+][S]  
20901217 SSO Disulfur monoxide InChI=1S/OS2/c1-3-2 TXKMVPPZCYKFAC-UHFFFAOYSA-N S=S=O   Sulfur oxide; sulfur oxide sulfide
15941772 SCN- thiocyanide anion InChI=1S/CNS/c2-1-3/q-1 ZBKFYXZXZJPWNQ-UHFFFAOYSA-N S=C=[N-]  
15941772 SCN thiocyanato radical InChI=1S/CNS/c2-1-3 NYAZXHASVIWIRJ-UHFFFAOYSA-N [N]=C=S  
7446095 SO2- Sulfur dioxide anion InChI=1S/HO2S/c1-3-2/h(H,1,2)/p-1 HYBXAXQJRPECRK-UHFFFAOYSA-M [O-][S]=O  
7446095 SO2- Sulfur dioxide anion InChI=1S/O2S/c1-3-2/q-1 SAKOVUXOZRPMTC-UHFFFAOYSA-N [O][S-][O]  
7446095 SO2 Sulfur dioxide InChI=1S/O2S/c1-3-2 RAHZWNYVWXNFOC-UHFFFAOYSA-N O=S=O   Bisulfite; Fermenicide liquid; Fermenicide powder; Fermenticide liquid; Schwefeldioxyd; Siarki dwutlenek; Sulfur dioxide; Sulfur oxide; Sulfur oxide (SO2); Sulfurous acid anhydride; Sulfurous anhydride; Sulfurous oxide; Sulphur dioxide; UN 1079
7446095 SO2+ Sulfur dioxide cation InChI=1S/O2S/c1-3-2/q+1 MBSJVKCGZVUJLB-UHFFFAOYSA-N [O][S+][O]  
463581 OCS Carbonyl sulfide InChI=1S/COS/c2-1-3 JJWKPURADFRFRB-UHFFFAOYSA-N O=C=S   Carbon oxide sulfide; Carbon oxide sulfide (COS); Carbon oxysulfide; Carbonyl sulfide; Oxycarbon sulfide; UN 2204
463581 OCS+ Carbonyl sulfide cation InChI=1S/COS/c2-1-3/q+1 BTRSGXSEZDOXRY-UHFFFAOYSA-N S=[C+]=O  
75150 CS2- Carbon disulfide anion InChI=1S/CS2/c2-1-3/q-1 IKZNEQNDDPLVNV-UHFFFAOYSA-N [S-][C]=S  
75150 CS2 Carbon disulfide InChI=1S/CS2/c2-1-3 QGJOPFRUJISHPQ-UHFFFAOYSA-N S=C=S   Carbon bisulfide; Carbon bisulphide; Carbon disulfide; Carbon sulfide; Carbon sulfide (CS2); Carbon sulphide; Carbon-disulphide-; Carbone; Carbonio; Dithiocarbonic anhydride; Kohlendisulfid; Koolstofdisulfide; NCI-C04591; Rcra waste number P022; Schwefelkohlenstoff; Solfuro di carbonio; Sulphocarbonic anhydride; UN 1131; Weeviltox; Wegla dwusiarczek
75150 CS2+ Carbon disulfide cation InChI=1S/CS2/c2-1-3/q+1 PGXKVSYXGLLKDQ-UHFFFAOYSA-N S=C=[S+]  
13845233 HSSSH trisulfane InChI=1S/H2S3/c1-3-2/h1-2H KBMBVTRWEAAZEY-UHFFFAOYSA-N SSS  
13845233 HSSSH trisulfane InChI=1S/H2S3/c1-3-2/h1-2H KBMBVTRWEAAZEY-UHFFFAOYSA-N SSS  
420122 C2H4S Thiirane InChI=1S/C2H4S/c1-2-3-1/h1-2H2 VOVUARRWDCVURC-UHFFFAOYSA-N S1CC1   2,3-Dihydrothiirene; Ethylene episulfide; Ethylene episulphide; Ethylene sulfide; Ethylene sulphide; Sulfurane; Thiacyclopropane; Thiirane; Thiirene, 2,3-dihydro-
6851930 CH3CHS Thioacetaldehyde InChI=1S/C2H4S/c1-2-3/h2H,1H3 QJFUMFCCMJJLIE-UHFFFAOYSA-N CC=S   Thioacetaldehyde; ethanethial
75183 CH3SCH3 Dimethyl sulfide InChI=1S/C2H6S/c1-3-2/h1-2H3 QMMFVYPAHWMCMS-UHFFFAOYSA-N CSC   2-Thiapropane; 2-Thiopropane; Dimethyl monosulfide; Dimethyl sulfide; Dimethyl sulphide; Dimethyl thioether; Dimethylsulfid; DMS; Exact-S; Methane, thiobis-; Methyl Monosulfide; Methyl sulfide; Methyl sulphide; Methylthiomethane; Sulfure de methyle; Thiobismethane; UN 1164; dimethylsulfane
75081 CH3CH2SH ethanethiol InChI=1S/C2H6S/c1-2-3/h3H,2H2,1H3 DNJIEGIFACGWOD-UHFFFAOYSA-N CCS   1-Mercaptoethane; Aethanethiol; Aethylmercaptan; Etantiolo; Ethaanthiol; Ethanethiol; Ethyl hydrosulfide; Ethyl mercaptan; Ethyl sulfhydrate; Ethyl thioalcohol; Ethylmercaptaan; Ethylmerkaptan; Etilmercaptano; LPG ethyl mercaptan 1010; Mercaptoethane; Thioethanol; Thioethyl alcohol; UN 2363
75081 CH3CH2SH ethanethiol InChI=1S/C2H6S/c1-2-3/h3H,2H2,1H3 DNJIEGIFACGWOD-UHFFFAOYSA-N CCS   1-Mercaptoethane; Aethanethiol; Aethylmercaptan; Etantiolo; Ethaanthiol; Ethanethiol; Ethyl hydrosulfide; Ethyl mercaptan; Ethyl sulfhydrate; Ethyl thioalcohol; Ethylmercaptaan; Ethylmerkaptan; Etilmercaptano; LPG ethyl mercaptan 1010; Mercaptoethane; Thioethanol; Thioethyl alcohol; UN 2363
13814250 SF2- sulfur difluoride anion InChI=1S/F2S/c1-3-2/q-1 OFRKWDJNZFLIKU-UHFFFAOYSA-N F[S-]F  
13814250 SF2- sulfur difluoride anion InChI=1S/F2S/c1-3-2/q-1 OFRKWDJNZFLIKU-UHFFFAOYSA-N F[S-]F  
13814250 SF2 sulfur difluoride InChI=1S/F2S/c1-3-2 QTJXVIKNLHZIKL-UHFFFAOYSA-N FSF  
13814250 SF2+ sulfur difluoride cation InChI=1S/F2S/c1-3-2/q+1 MZABPRZNSYSBEJ-UHFFFAOYSA-N F[S+]F  
17376099 ClOO chloroperoxy radical InChI=1S/ClO2/c1-3-2 ASCHNMXUWBEZDM-UHFFFAOYSA-N ClO[O]  
17376099 ClOO+ chloroperoxy cation InChI=1S/ClO2/c1-3-2/q+1 JILSWHWPVMTOIP-UHFFFAOYSA-N Cl[O+]=O  
18434338 Cl3- trichloride anion InChI=1S/Cl3/c1-3-2/q-1 MYTVFXOCDZDTLX-UHFFFAOYSA-N Cl[Cl-]Cl  
13569329 SiCl2 Dichlorosilylene InChI=1S/Cl2Si/c1-3-2 BUMGIEFFCMBQDG-UHFFFAOYSA-N Cl[Si]Cl   Dichlorosilylene; silicon dichloride
10545990 SCl2 Sulfur dichloride InChI=1S/Cl2S/c1-3-2 FWMUJAIKEJWSSY-UHFFFAOYSA-N ClSCl   Sulfur chloride; Chlorine sulfide; Dichlorosulfane; Monosulfur dichloride; Sulfur(II) chloride; Chloride of sulfur; Chlorine sulfide; UN 1828; hypochlorous thioanhydride
10049044 OClO- Chlorine dioxide anion InChI=1S/ClO2/c2-1-3/q-1 GXXLZZYHIIGRLP-UHFFFAOYSA-N [O-]Cl[O]  
10049044 OClO- Chlorine dioxide anion InChI=1S/ClHO2/c2-1-3/h(H,2,3)/p-1 QBWCMBCROVPCKQ-UHFFFAOYSA-M  
10049044 OClO Chlorine dioxide InChI=1S/ClO2/c2-1-3 OSVXSBDYLRYLIG-UHFFFAOYSA-N O=Cl[O]   Alcide; Anthium dioxcide; Chlorine dioxide; Chlorine oxide; Chlorine oxide (ClO2); Chlorine peroxide; Chlorine(IV) oxide; Chloroperoxyl; Chloryl radical; Doxcide 50
10049044 OClO+ Chlorine dioxide cation InChI=1S/ClO2/c2-1-3/q+1 UVQYMEMTCMFUIN-UHFFFAOYSA-N [O][Cl+][O]  
39594917 ClS2 Sulfur chloride InChI=1S/ClS2/c1-3-2 ASGYIKBYZKQKJC-UHFFFAOYSA-N ClS[S]   Sulfur chloride
506774 ClCN chlorocyanogen InChI=1S/CClN/c2-1-3 QPJDMGCKMHUXFD-UHFFFAOYSA-N N#CCl   Chlorcyan; Chlorine cyanide; Chlorocyan; Chlorocyanide; Chlorocyanogen; Chlorure de cyanogene; CK; Cyanochloride; Cyanogen chloride; Cyanogen chloride ((CN)Cl); Cyanogen chloride, inhibited; Rcra waste number P033; UN 1589; cyanic chloride
2696926 ClNO Nitrosyl chloride InChI=1S/ClNO/c1-2-3 VPCDQGACGWYTMC-UHFFFAOYSA-N O=NCl   Nitrogen chloride oxide (NOCl); Nitrogen oxide chloride (NOCl); Nitrogen oxychloride; Nitrogen oxychloride (NOCl); Nitrosyl chloride; Nitrosyl chloride ((NO)Cl); UN 1069
2602428 ClCO carbonyl monochloride InChI=1S/CClO/c2-1-3 DDKMFOUTRRODRE-UHFFFAOYSA-N O=[C]Cl  
2602428 ClCO carbonyl monochloride InChI=1S/CClO/c2-1-3 DDKMFOUTRRODRE-UHFFFAOYSA-N O=[C]Cl  
1605727 CCl2- dichloromethylene anion InChI=1S/CCl2/c2-1-3/q-1 OZJHVHSKMWSCKB-UHFFFAOYSA-N Cl[C]Cl  
1605727 CCl2 dichloromethylene InChI=1S/CCl2/c2-1-3 PFBUKDPBVNJDEW-UHFFFAOYSA-N Cl[C]Cl  
1605727 CCl2+ dichloromethylene cation InChI=1S/CCl2/c2-1-3/q+1 BMNPTARFHVPKCA-UHFFFAOYSA-N Cl[C+]Cl  
7786303 MgCl2 Magnesium dichloride InChI=1S/2ClH.Mg/h2*1H;/q;;+2/p-2 TWRXJAOTZQYOKJ-UHFFFAOYSA-L Cl[Mg]Cl   Magnesium chloride
7787475 BeCl2 Beryllium chloride InChI=1S/Be.2ClH/h;2*1H/q+2;;/p-2 LWBPNIJBHRISSS-UHFFFAOYSA-L Cl[Be]Cl  
7791211 Cl2O Dichlorine monoxide InChI=1S/Cl2O/c1-3-2 RCJVRSBWZCNNQT-UHFFFAOYSA-N ClOCl   Chlorine monooxide; Chlorine monoxide; Chlorine monoxide (Cl2O); Chlorine oxide; Chlorine oxide (Cl2O); Chlorine(I) oxide; Dichlorine monoxide; Dichloromonoxide; Dichloroxide; Hypochlorous anhydride
2565302 COHCl Formyl chloride InChI=1S/CHClO/c2-1-3/h1H GFAUNYMRSKVDJL-UHFFFAOYSA-N O=CCl  
3474122 CHCl2 dichloromethyl radical InChI=1S/CHCl2/c2-1-3/h1H Cl[CH]Cl   Methyl, dichloro-; Dichloromethyl
593635 HCCCl Chloroacetylene InChI=1S/C2HCl/c1-2-3/h1H DIWKDXFZXXCDLF-UHFFFAOYSA-N C#CCl   Ethyne, chloro-; Acetylene, chloro-; Chloroethyne; Ethynyl chloride; Monochloroacetylene
10325390 BHCl2 Borane, dichloro- InChI=1S/BCl2H/c2-1-3/h1H LHCGBIFHSCCRRG-UHFFFAOYSA-N ClBCl   Borane, dichloro-; Dichloroborane
13898470 HOClO Chlorous acid InChI=1S/ClHO2/c2-1-3/h2H NPWPEPVYKMPDKK-UHFFFAOYSA-N OCl[O]   Chlorous acid
13898470 HOClO Chlorous acid InChI=1S/ClHO2/c2-1-3/h2H NPWPEPVYKMPDKK-UHFFFAOYSA-N OCl[O]   Chlorous acid
593704 CH2FCl fluorochloromethane InChI=1S/CH2ClF/c2-1-3/h1H2 XWCDCDSDNJVCLO-UHFFFAOYSA-N ClCF   Methane, chlorofluoro-; Chlorofluoromethane; Freon 31; Monochloromonofluoromethane; R 31
75092 CH2Cl2 Methylene chloride InChI=1S/CH2Cl2/c2-1-3/h1H2 YMWUJEATGCHHMB-UHFFFAOYSA-N ClCCl   Aerothene MM; Chlorure de methylene; DCM; Dichloromethane; Freon 30; Methane dichloride; Methane, dichloro-; Methylene bichloride; Methylene Chloride; Methylene dichloride; Metylenu chlorek; Narkotil; NCI-C50102; R 30; Rcra waste number U080; Solaesthin; Solmethine; UN 1593
4109960 SiH2Cl2 dichlorosilane InChI=1S/Cl2H2Si/c1-3-2/h3H2 MROCJMGDEKINLD-UHFFFAOYSA-N Cl[SiH2]Cl  
75014 CH2CHCl Ethene, chloro- InChI=1S/C2H3Cl/c1-2-3/h2H,1H2 BZHJMEDXRYGGRV-UHFFFAOYSA-N ClC=C   Chlorethene; Chlorethylene; Chloroethene; Chloroethylene; Chlorure de vinyle; Cloruro di vinile; Ethene, chloro-; Ethylene monochloride; Ethylene, chloro-; Monochloroethene; Monochloroethylene; Rcra waste number U043; Vinyl chloride monomer; Vinylchlorid; Winylu chlorek; VC; Vinyl C monomer; Vinyl chloride; Vinyl chloride, inhibited; Trovidur; Vinyle(chlorure de); UN 1086; VCM; Vinile
593782 CH3OCl methyl hypochlorite InChI=1S/CH3ClO/c1-3-2/h1H3 UCFFGYASXIPWPD-UHFFFAOYSA-N COCl  
75003 CH3CH2Cl Ethyl chloride InChI=1S/C2H5Cl/c1-2-3/h2H2,1H3 HRYZWHHZPQKTII-UHFFFAOYSA-N CCCl   Aethylchlorid; Aethylis; Aethylis chloridum; Anodynon; Chelen; Chloorethaan; Chlorene; Chlorethyl; Chloridum; Chloroaethan; Chloroethane; Chlorure D'ethyle; Chloryl; Chloryl anesthetic; Cloretilo; Cloroetano; Cloruro di etile; Dublofix; Ethane, chloro-; Ether chloratus; Ether hydrochloric; Ether muriatic; Ethyl Chloride; Etylu chlorek; Hydrochloric ether; Kelene; Monochlorethane; Monochloroethane; Muriatic ether; Narcotile; NCI-C06224; UN 1037
7789755 CaF2 Calcium difluoride InChI=1S/Ca.2FH/h;2*1H/q+2;;/p-2 WUKWITHWXAAZEY-UHFFFAOYSA-L F[Ca]F   Fluorite; Calcium fluoride; Acid-spar; Fluorspar
10043524 CaCl2 Calcium Chloride InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2 UXVMQQNJUSDDNG-UHFFFAOYSA-L Cl[Ca]Cl  
13463677 TiO2 Titanium dioxide InChI=1S/2O.Ti GWEVSGVZZGPLCZ-UHFFFAOYSA-N O=[Ti]=O  
544923 CuCN Copper cyanide InChI=1S/CN.Cu/c1-2; DULSAGLWMRMKCQ-UHFFFAOYSA-N [Cu]C#N   cyanocopper
7789197 CuF2 Copper difluoride InChI=1S/Cu.2FH/h;2*1H/q+2;;/p-2 GWFAVIIMQDUCRA-UHFFFAOYSA-L F[Cu]F  
544978 Zn(CH3)2 dimethyl zinc InChI=1S/2CH3.Zn/h2*1H3; AXAZMDOAUQTMOW-UHFFFAOYSA-N C[Zn]C  
544978 Zn(CH3)2 dimethyl zinc InChI=1S/2CH3.Zn/h2*1H3; AXAZMDOAUQTMOW-UHFFFAOYSA-N C[Zn]C  
544978 Zn(CH3)2 dimethyl zinc InChI=1S/2CH3.Zn/h2*1H3; AXAZMDOAUQTMOW-UHFFFAOYSA-N C[Zn]C  
9000140 ZnCN Zinc monocyanide InChI=1S/CN.Zn/c1-2; VHYRVMOCOPKSBP-UHFFFAOYSA-N [Zn]C#N  
9000140 ZnCN Zinc monocyanide InChI=1S/CN.Zn/c1-2; VHYRVMOCOPKSBP-UHFFFAOYSA-N [Zn]C#N  
7783495 ZnF2 Zinc difluoride InChI=1S/2FH.Zn/h2*1H;/q;;+2/p-2 BHHYHSUAOQUXJK-UHFFFAOYSA-L F[Zn]F  
7783495 ZnF2 Zinc difluoride InChI=1S/2FH.Zn/h2*1H;/q;;+2/p-2 BHHYHSUAOQUXJK-UHFFFAOYSA-L F[Zn]F  
7646857 ZnCl2 Zinc dichloride InChI=1S/2ClH.Zn/h2*1H;/q;;+2/p-2 JIAARYAFYJHUJI-UHFFFAOYSA-L Cl[Zn]Cl   Zinc chloride; zinc(II) chloride
7646857 ZnCl2 Zinc dichloride InChI=1S/2ClH.Zn/h2*1H;/q;;+2/p-2 JIAARYAFYJHUJI-UHFFFAOYSA-L Cl[Zn]Cl   Zinc chloride; zinc(II) chloride
1310538 GeO2 Germanium dioxide InChI=1S/GeO2/c2-1-3 YBMRDBCBODYGJE-UHFFFAOYSA-N [O][Ge][O]  
12025342 GeS2 Germanium disulfide InChI=1S/GeS2/c2-1-3 YIZVROFXIVWAAZ-UHFFFAOYSA-N S=[Ge]=S   germanium disulphide
10060114 GeCl2 Germanium dichloride InChI=1S/Cl2Ge/c1-3-2 QHGIKMVOLGCZIP-UHFFFAOYSA-N Cl[Ge]Cl  
13940631 GeF2 Germanium difluoride InChI=1S/F2Ge/c1-3-2 GGJOARIBACGTDV-UHFFFAOYSA-N F[Ge]F  
12255128 AsO2 Aresenic dioxide InChI=1S/AsO2/c2-1-3 LZYIDMKXGSDQMT-UHFFFAOYSA-N [O][As][O]  
1603845 OCSe Carbonyl selenide InChI=1S/COSe/c2-1-3 RQZJHKMUYSXABM-UHFFFAOYSA-N O=C=[Se]  
7446084 SeO2 Selenium dioxide InChI=1S/O2Se/c1-3-2 JPJALAQPGMAKDF-UHFFFAOYSA-N O=[Se]=O   Selenium(IV) oxide; Selenium oxide; selenium dioxide
506809 CSe2 Carbon diselenide InChI=1S/CSe2/c2-1-3 JNZSJDBNBJWXMZ-UHFFFAOYSA-N [Se]=C=[Se]   Carbon selenide
506683 BrCN Cyanogen bromide InChI=1S/CBrN/c2-1-3 ATDGTVJJHBUTRL-UHFFFAOYSA-N N#CBr   Bromine cyanide; Bromocyan; Bromocyanide; Bromocyanogen; Cyanobromide; Cyanogen monobromide; Bromine monocyanide; Cyanic bromide
9000328 BrOCl BrOCl InChI=1S/BrClO/c1-3-2 QZMLUZQWJCKBQO-UHFFFAOYSA-N BrOCl  
13444876 BrNO Nitrosyl bromide InChI=1S/BrNO/c1-2-3 BMNDJWSIKZECMH-UHFFFAOYSA-N BrN=O  
21255834 OBrO OBrO InChI=1S/BrO2/c2-1-3 SISAYUDTHCIGLM-UHFFFAOYSA-N [O]Br[O]  
21308805 BrOBr Bromine oxide InChI=1S/Br2O/c1-3-2 HJCMMOODWZOXML-UHFFFAOYSA-N BrOBr  
7726116 COHBr COHBr InChI=1S/CHBrO/c2-1-3/h1H AIFARXRIYKCEEV-UHFFFAOYSA-N O=CBr  
74975 CH2ClBr Methane, bromochloro- InChI=1S/CH2BrCl/c2-1-3/h1H2 JPOXNPPZZKNXOV-UHFFFAOYSA-N ClCBr   Bromochloromethane; Chlorobromomethane; Monochloromonobromomethane; Methylene chlorobromide
74953 CH2Br2 dibromomethane InChI=1S/CH2Br2/c2-1-3/h1H2 FJBFPHVGVWTDIP-UHFFFAOYSA-N BrCBr   Methylene dibromide; Dibromomethane; Methane, dibromo-; Methylene bromide
593602 C2H3Br vinyl bromide InChI=1S/C2H3Br/c1-2-3/h2H,1H2 INLLPKCGLOXCIV-UHFFFAOYSA-N C=CBr   Ethene, bromo-; Vinylbromid; UN 1085; Bromoethene; Ethylene, bromo-; Bromoethylene; Bromure de vinyle; NCI-C50373
74964 C2H5Br Ethyl bromide InChI=1S/C2H5Br/c1-2-3/h2H2,1H3 RDHPKYGYEGBMSE-UHFFFAOYSA-N CCBr   Halon 2001; Hydrobromic ether; Bromure d'ethyle; Monobromoethane; Bromoethane; NCI-C55481; Ethane, bromo-; Bromic ether; 1-Bromoethane; UN 1891
13773814 KrF2 Krypton difluoride InChI=1S/F2Kr/c1-3-2 QGOSZQZQVQAYFS-UHFFFAOYSA-N F[Kr]F  
18283937 B4H10 Tetraborane(10) InChI=1S/B4H10/c5-1-3(5)2(7-3)4(1,3,6-1)8-2/h3-4H,1-2H2 WEYOKDYZYYMRSQ-UHFFFAOYSA-N   Boron hydride; Decahydrotetraborane; Tetraborane; arachno-tratraborane(10)
12184804 C4 Carbon tetramer InChI=1S/C4/c1-2-4-3-1 ZJRINDVWMDPKLP-UHFFFAOYSA-N [C]=C=C=[C]  
12184804 C4+ Carbon tetramer cation InChI=1S/C4/c1-3-4-2/q+1 SADAPCZSPKDXDW-UHFFFAOYSA-N [C]=C=C=[C+]  
460128 C4H2 Diacetylene InChI=1S/C4H2/c1-3-4-2/h1-2H LLCSWKVOHICRDD-UHFFFAOYSA-N C#CC#C   Biethynyl; Biacetylene; 1,3-Butadiyne; Butadiyne; buta-1,3-diyne
460128 C4H2 Diacetylene InChI=1S/C4H2/c1-3-4-2/h1-2H LLCSWKVOHICRDD-UHFFFAOYSA-N C#CC#C   Biethynyl; Biacetylene; 1,3-Butadiyne; Butadiyne; buta-1,3-diyne
460128 C4H2+ diacetlyene cation InChI=1S/C4H2/c1-3-4-2/h1-2H/q+1 VHBKEPSJRWPSHQ-UHFFFAOYSA-N [CH+]=[C]C#C  
689974 C2H3CCH 1-Buten-3-yne InChI=1S/C4H4/c1-3-4-2/h1,4H,2H2 WFYPICNXBKQZGB-UHFFFAOYSA-N C=CC#C   Ethene, ethynyl-; Vinylacetylene; Buten-3-yne; But-1-en-3-yne; Ethynylethene; Monovinylacetylene; 1-Butyn-3-ene; 1-Butene-3-yne; Butenyne; 1-Butenyne; 3-Buten-1-yne
1120532 C4H4 cyclobutadiene InChI=1S/C4H4/c1-2-4-3-1/h1-4H HWEQKSVYKBUIIK-UHFFFAOYSA-N C1=CC=C1  
1120532 C4H4 cyclobutadiene InChI=1S/C4H4/c1-2-4-3-1/h1-4H HWEQKSVYKBUIIK-UHFFFAOYSA-N C1=CC=C1  
2873509 H2CCCCH2 Butatriene InChI=1S/C4H4/c1-3-4-2/h1-2H2 WHVXVDDUYCELKP-UHFFFAOYSA-N C=C=C=C  
3100047 C4H6 1-Methylcyclopropene InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3 SHDPRTQPPWIEJG-UHFFFAOYSA-N CC1=CC1   1-Methylcyclopropene; Cyclopropene, 1-methyl-; 1-methylcycloprop-1-ene
6142730 C4H6 Methylenecyclopropane InChI=1S/C4H6/c1-4-2-3-4/h1-3H2 XSGHLZBESSREDT-UHFFFAOYSA-N C=C1CC1  
822355 C4H6 Cyclobutene InChI=1S/C4H6/c1-2-4-3-1/h1-2H,3-4H2 CFBGXYDUODCMNS-UHFFFAOYSA-N C1=CCC1   Cyclobutene
503173 CH3CCCH3 2-Butyne InChI=1S/C4H6/c1-3-4-2/h1-2H3 XNMQEEKYCVKGBD-UHFFFAOYSA-N CC#CC   2-Butyne; But-2-yne; Crotonylene; Dimethylacetylene; UN 1144; butyne
590192 CH2CCHCH3 1,2-Butadiene InChI=1S/C4H6/c1-3-4-2/h4H,1H2,2H3 QNRMTGGDHLBXQZ-UHFFFAOYSA-N C=C=CC   1,2-Butadiene; Allene, methyl-; Methylallene; buta-1,2-diene
106990 CH2CHCHCH2 1,3-Butadiene InChI=1S/C4H6/c1-3-4-2/h3-4H,1-2H2 KAKZBPTYRLMSJV-UHFFFAOYSA-N C=CC=C   α,γ-Butadiene; 1,3-Butadiene; (E)-CH2=CHCH=CH2; Biethylene; Bivinyl; Buta-1,3-dieen; Buta-1,3-dien; Buta-1,3-diene; Butadieen; Butadien; Butadiene; Divinyl; Erythrene; NCI-C50602; Pyrrolylene; trans-Butadiene; Vinylethylene; alpha,gamma-Butadiene; 1,3butadiene
106990 CH2CHCHCH2 1,3-Butadiene InChI=1S/C4H6/c1-3-4-2/h3-4H,1-2H2 KAKZBPTYRLMSJV-UHFFFAOYSA-N   α,γ-Butadiene; 1,3-Butadiene; (E)-CH2=CHCH=CH2; Biethylene; Bivinyl; Buta-1,3-dieen; Buta-1,3-dien; Buta-1,3-diene; Butadieen; Butadien; Butadiene; Divinyl; Erythrene; NCI-C50602; Pyrrolylene; trans-Butadiene; Vinylethylene; alpha,gamma-Butadiene; 1,3butadiene
107006 CHCCH2CH3 1-Butyne InChI=1S/C4H6/c1-3-4-2/h1H,4H2,2H3 KDKYADYSIPSCCQ-UHFFFAOYSA-N C#CCC   1-Butyne; Butyne-1; Ethyl acetylene, inhibited; Ethylacetylene; Ethylethyne; UN 2452; butyne; but-1-yne
16520211 CH3CHCHCH2 methylallyl radical InChI=1S/C4H7/c1-3-4-2/h3-4H,1H2,2H3 CRPTXKKKIGGDBX-UHFFFAOYSA-N [CH2]/C=C/C  
16520211 CH3CHCHCH2 methylallyl radical InChI=1S/C4H7/c1-3-4-2/h3-4H,1H2,2H3/b4-3+ CRPTXKKKIGGDBX-ONEGZZNKSA-N [CH2]/C=C/C  
106989 CH2CHCH2CH3 1-Butene InChI=1S/C4H8/c1-3-4-2/h3H,1,4H2,2H3 VXNZUUAINFGPBY-UHFFFAOYSA-N C=CCC   α-Butene; α-Butylene; 1-Butene; 1-Butylene; 1-C4H8; But-1-ene; Butene-1; Ethylethylene; butene; alpha-Butene; alpha-Butylene
590181 CH3CHCHCH3 2-Butene, (Z)- InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3/b4-3- IAQRGUVFOMOMEM-ARJAWSKDSA-N C/C=C\C   2-Butene, (Z)-; (Z)-2-Butene; (Z)-2-C4H8; cis-1,2-Dimethylethylene; cis-2-Butene; cis-Butene; cis-Butylene; Dimethylethylene; butene; 2-butene; (Z)-but-2-ene
594116 C4H8 methylcyclopropane InChI=1S/C4H8/c1-4-2-3-4/h4H,2-3H2,1H3 VNXBKJFUJUWOCW-UHFFFAOYSA-N CC1CC1  
624646 CH3CHCHCH3 2-Butene, (E)- InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3/b4-3+ IAQRGUVFOMOMEM-ONEGZZNKSA-N C/C=C/C   2-Butene, (E)-; (E)-2-Butene; (E)-2-C4H8; 2-trans-Butene; trans-1,2-Dimethylethylene; trans-2-Butene; trans-Butene; butene; 2-butene; (E)-but-2-ene
115117 CH2C(CH3)CH3 1-Propene, 2-methyl- InChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3 VQTUBCCKSQIDNK-UHFFFAOYSA-N C=C(C)C   1-Propene, 2-methyl-; γ-Butylene; 1,1-Dimethylethylene; 2-Methyl-1-propene; 2-Methylpropene; 2-Methylpropene-isobutylene; Isobutene; Isobutylene; iso-C4H8; Isopropylidenemethylene; Liquefied petroleum gas; Methylpropene; Propene, 2-methyl-; UN 1055; UN 1075; gamma-Butylene; 2-methylprop-1-ene
1605738 C(CH3)3 Tert-butyl radical InChI=1S/C4H9/c1-4(2)3/h1-3H3 IIVWHGMLFGNMOW-UHFFFAOYSA-N C[C](C)C   tert-Butyl radical; tert-C4H9; 2-Methylpropan-2-yl
4630459 CH2CH(CH3)2 Isobutyl radical InChI=1S/C4H9/c1-4(2)3/h4H,1H2,2-3H3 KTOQRRDVVIDEAA-UHFFFAOYSA-N [CH2]C(C)C   1-Propyl radical, 2-methyl-; Isobutyl radical; iso-C4H9; 2-Methylpropan-1-yl
2348552 CH3CHCH2CH3 2-Butyl radical InChI=1S/C4H9/c1-3-4-2/h3H,4H2,1-2H3 ULOIAOPTGWSNHU-UHFFFAOYSA-N C[CH]CC   2-Butyl radical; sec-Butyl radical; sec-C4H9; butan-2-yl
106978 CH3CH2CH2CH3 Butane InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3 IJDNQMDRQITEOD-UHFFFAOYSA-N CCCC   Butane; Butanen; Butani; Diethyl; Freon 600; Liquefied petroleum gas; LPG; Methylethylmethane; n-Butane; n-C4H10; UN 1011; UN 1075
106978 CH3CH2CH2CH3 Butane InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3 IJDNQMDRQITEOD-UHFFFAOYSA-N CCCC   Butane; Butanen; Butani; Diethyl; Freon 600; Liquefied petroleum gas; LPG; Methylethylmethane; n-Butane; n-C4H10; UN 1011; UN 1075
75285 CH3CH(CH3)CH3 Isobutane InChI=1S/C4H10/c1-4(2)3/h4H,1-3H3 NNPPMTNAJDCUHE-UHFFFAOYSA-N CC(C)C   1,1-Dimethylethane; 2-Methylpropane; A 31; i-Butane; Isobutane; Isobutane mixtures; iso-C4H10; Liquefied petroleum gas; Propane, 2-methyl-; R 600a; tert-Butane; UN 1969; UN 1075; Trimethylmethane
157335 C4H6 Bicyclo[1.1.0]butane InChI=1S/C4H6/c1-3-2-4(1)3/h3-4H,1-2H2 LASLVGACQUUOEB-UHFFFAOYSA-N [C@@H]12C[C@@H]1C2   Bicyclo[1.1.0]butane
287230 C4H8 cyclobutane InChI=1S/C4H8/c1-2-4-3-1/h1-4H2 PMPVIKIVABFJJI-UHFFFAOYSA-N C1CCC1   Cyclobutane; Tetramethylene; UN 2601
460195 C2N2 Cyanogen InChI=1S/C2N2/c3-1-2-4 JMANVNJQNLATNU-UHFFFAOYSA-N N#CC#N   Carbon nitride; Carbon nitride (C2N2); Cyanogen; Cyanogen (C2N2); Cyanogen gas; Cyanogene; Dicyan; Dicyanogen; Ethanedinitrile; NCCN; Nitriloacetonitrile; Oxalic acid dinitrile; Oxalic nitrile; Oxalonitrile; Oxalyl cyanide; Prussite; Rcra waste number P031; UN 1026
460195 C2N2+ Cyanogen cation InChI=1S/C2N2/c3-1-2-4/q+1 NPEMKTLMDYAXKQ-UHFFFAOYSA-N N#[C+]C#N  
26134623 Li3N trilithium nitride InChI=1S/3Li.N IDBFBDSKYCUNPW-UHFFFAOYSA-N [Li]N([Li])[Li]  
26134623 Li3N trilithium nitride InChI=1S/3Li.N IDBFBDSKYCUNPW-UHFFFAOYSA-N [Li]N([Li])[Li]  
1070719 HCCCN Cyanoacetylene InChI=1S/C3HN/c1-2-3-4/h1H LNDJVIYUJOJFSO-UHFFFAOYSA-N C#CC#N   Propiolonitrile; Cyanaethylene; Cyanoethyne; Propynenitrile; 2-Propynenitrile
1070719 HCCCN+ Cyanoacetylene cation InChI=1S/C3HN/c1-2-3-4/h1H/q+1 HWYNWVPZAQTDKQ-UHFFFAOYSA-N [CH+]=C=C=[N]  
624908 CH3N3 methyl azide InChI=1S/CH3N3/c1-3-4-2/h1H3 CN=[N+]=[N-]  
107131 C3H3N acrylonitrile InChI=1S/C3H3N/c1-2-3-4/h2H,1H2 NLHHRLWOUZZQLW-UHFFFAOYSA-N C=CC#N   2-Propenenitrile; Acritet; Acrylnitril; Acrylon; Acrylonitrile; Acrylonitrile monomer; Acrylonitrile, inhibited; Akrylonitril; Akrylonitryl; Carbacryl; Cianuro di vinile; Cyanoethene; Cyanoethylene; Cyanure de vinyle; ENT 54; Fumigrain; Miller's fumigrain; Nitrile acrilico; Nitrile acrylique; Propenenitrile; Rcra waste number U009; TL 314; VCN; Ventox; Vinylkyanid; UN 1093; Vinyl cyanide
107131 C3H3N+ acrylonitrile cation InChI=1S/C3H3N/c1-2-3-4/h2H,1H2/q+1 ZEKYDXZLIPYKBD-UHFFFAOYNA-N [CH2][CH+]C#N  
107120 C2H5CN ethyl cyanide InChI=1S/C3H5N/c1-2-3-4/h2H2,1H3 FVSKHRXBFJPNKK-UHFFFAOYSA-N CCC#N   Propanenitrile; Propionitrile; Cyanoethane; Ether cyanatus; Ethyl cyanide; Hydrocyanic ether; Propionic nitrile; Propiononitrile; Propylnitrile; UN 2404
113008 CH5N3 Guanidine InChI=1S/CH5N3/c2-1(3)4/h(H5,2,3,4) ZRALSGWEFCBTJO-UHFFFAOYSA-N N=C(N)N   Aminoformamidine; Aminomethanamidine; Carbamamidine; Carbamidine; Guanidin; Imidourea; Iminourea
4143424 CH3NNCH3 (Z)-1,2-Dimethyldiazene InChI=1S/C2H6N2/c1-3-4-2/h1-2H3/b4-3- JCCAVOLDXDEODY-ARJAWSKDSA-N C/N=N\C   1,2-Dimethyldiazene; Azomethane
4143424 CH3NNCH3 (Z)-1,2-Dimethyldiazene InChI=1S/C2H6N2/c1-3-4-2/h1-2H3/b4-3- JCCAVOLDXDEODY-ARJAWSKDSA-N C/N=N\C   1,2-Dimethyldiazene; Azomethane
25215105 CH6N3+ guanidinium InChI=1S/CH6N3/c2-1(3)4/h2-4H2/q+1 GEGUZNURYPPRAR-UHFFFAOYSA-N N[C+](N)N  
25215105 CH6N3+ guanidinium InChI=1S/CH6N3/c2-1(3)4/h2-4H2/q+1 GEGUZNURYPPRAR-UHFFFAOYSA-N N[C+](N)N  
765300 C3H7N Cyclopropylamine InChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2 HTJDQJBWANPRPF-UHFFFAOYSA-N NC1CC1   Aminocyclopropane; Cyclopropanamine; Cyclopropylamine
540738 CH3NHNHCH3 dimethyl hydrazine InChI=1S/C2H8N2/c1-3-4-2/h3-4H,1-2H3 DIIIISSCIXVANO-UHFFFAOYSA-N CNNC   Hydrazine, 1,2-dimethyl-; s-Dimethylhydrazine; DMH; N,N'-Dimethylhydrazine; 1,2-Dimethylhydrazine; sym-Dimethylhydrazine; Dimethylhydrazine
107153 C2H8N2 Ethylenediamine InChI=1S/C2H8N2/c3-1-2-4/h1-4H2 PIICEJLVQHRZGT-UHFFFAOYSA-N NCCN   β-Aminoethylamine; 1,2-Diaminoaethan; 1,2-Diamino-ethaan; 1,2-Diaminoethane; 1,2-Diamino-ethano; 1,2-Ethanediamine; 1,2-Ethylenediamine; Aethaldiamin; Aethylenediamin; Diaminoethane; Dimethylenediamine; Ethane-1,2-diamine; Ethyleendiamine; Ethylendiamine; Ethylenediamine; NCI-C60402; UN 1604; beta-Aminoethylamine; en
107108 NH2CH2CH2CH3 1-Propanamine InChI=1S/C3H9N/c1-2-3-4/h2-4H2,1H3 WGYKZJWCGVVSQN-UHFFFAOYSA-N CCCN   1-Propanamine; 1-Propylamine; 1-Aminopropane; Mono-n-propylamine; Monopropylamine; n-C3H7NH2; n-Propylamine; Propanamine; Propylamine; Rcra waste number U194; UN 1277; propan-1-amine
75310 CH3CH(NH2)CH3 2-Propanamine InChI=1S/C3H9N/c1-3(2)4/h3H,4H2,1-2H3 JJWLVOIRVHMVIS-UHFFFAOYSA-N CC(C)N   1-Methylethylamine; 2-Amino-propaan; 2-Aminopropan; 2-Aminopropane; 2-Amino-propano; 2-Propanamine; 2-Propylamine; iso-C3H7NH2; Isopropilamina; Isopropylamine; MIPA; Monoisopropylamine; Propane, 2-amino-; Propylamine mono; sec-Propylamine; UN 1221; propan-2-amine
75503 N(CH3)3 Trimethylamine InChI=1S/C3H9N/c1-4(2)3/h1-3H3 GETQZCLCWQTVFV-UHFFFAOYSA-N CN(C)C   Methanamine, N,N-dimethyl-; Methylamine, N,N-dimethyl-; TMA; Trimethylamine; UN 1083; UN 1297
9000910 C3H7NH3+ n-propylamine, protonated  
4143413 CH3NNCH3 (E)-1,2-Dimethyldiazene InChI=1S/C2H6N2/c1-3-4-2/h1-2H3/b4-3+ JCCAVOLDXDEODY-ONEGZZNKSA-N C/N=N/C   Azomethane; 1,2-Dimethyldiazene; (E)-Dimethyldiazene
12144057 CO3-- carbonate InChI=1S/CH2O3/c2-1(3)4/h(H2,2,3,4)/p-2 BVKZGUZCCUSVTD-UHFFFAOYSA-L [O-]C([O-])=O  
12144057 CO3 Carbon trioxide InChI=1S/CO3/c2-1(3)4 DPFFXSPEODLYOH-UHFFFAOYSA-N O=C([O])[O]  
12033497 NO3- nitrate anion InChI=1S/NO3/c2-1(3)4/q-1 NHNBFGGVMKEFGY-UHFFFAOYSA-N [O][N-]([O])[O]   nitrate
12033497 NO3 Nitrogen trioxide InChI=1S/NO3/c2-1(3)4 YPJKMVATUPSWOH-UHFFFAOYSA-N [O]N(=O)=O   Nitrogen oxide; Nitrogen trioxide
12033497 NO3 Nitrogen trioxide InChI=1S/NO3/c2-1(3)4 YPJKMVATUPSWOH-UHFFFAOYSA-N [O]N(=O)=O   Nitrogen oxide; Nitrogen trioxide
12033497 NO3+ nitrogen trioxide cation InChI=1S/NO3/c2-1(3)4/q+1 MGUAMNYNQZUFET-UHFFFAOYSA-N [O][N+]([O])=O  
12033497 NO3+ nitrogen trioxide cation InChI=1S/NO3/c2-1(3)4/q+1 MGUAMNYNQZUFET-UHFFFAOYSA-N [O][N+]([O])=O  
13766284 B2O2 Diboron dioxide InChI=1S/B2O2/c3-1-2-4 MTKRXXSLFWZJTB-UHFFFAOYSA-N O=BB=O   Boron oxide; Diboron dioxide; diboron(III) dioxide
57932566 ONNO NO dimer InChI=1S/N2O2/c3-1-2-4 AZLYZRGJCVQKKK-UHFFFAOYSA-N O=NN=O  
57932566 ONNO NO dimer InChI=1S/N2O2/c3-1-2-4 AZLYZRGJCVQKKK-UHFFFAOYSA-N O=NN=O  
7697372 HNO3 Nitric acid InChI=1S/HNO3/c2-1(3)4/h(H,2,3,4) GRYLNZFGIOXLOG-UHFFFAOYSA-N O=N(O)=O   Acide nitrique; Acido nitrico; Aqua fortis; Azotic acid; Azotowy kwas; Hydrogen nitrate; Kyselina dusicne; NA 1760; Nitric Acid; Nitric acid fuming; Salpetersaure; Salpeterzuuroplossingen; UN 2031
71523 HCO3- bicarbonate anion InChI=1S/CH2O3/c2-1(3)4/h(H2,2,3,4)/p-1 BVKZGUZCCUSVTD-UHFFFAOYSA-M O=C([O-])O  
71523 HCO3- bicarbonate anion InChI=1/CH2O3/c2-1(3)4/h(H2,2,3,4)/p-1/fCHO3/h2H/q-1 BVKZGUZCCUSVTD-XLCNKCPPNA-M O=C([O-])O  
107222 C2H2O2 Ethanedial InChI=1S/C2H2O2/c3-1-2-4/h1-2H LEQAOMBKQFMDFZ-UHFFFAOYSA-N O=CC=O   1,2-Ethanedione; Biformal; Biformyl; Diformal; Diformyl; Ethandial; Ethane-1,2-dione; Ethanedial; Ethanedione; Glyoxal; Glyoxal aldehyde; Glyoxylaldehyde; Oxal; Oxalaldehyde
107222 C2H2O2+ Ethanedial cation InChI=1S/C2H2O2/c3-1-2-4/h1-2H/q+1 MDQCOWQKHDZDPL-UHFFFAOYSA-N [O][CH+]C=O  
463796 H2CO3 Carbonic acid InChI=1S/CH2O3/c2-1(3)4/h(H2,2,3,4) BVKZGUZCCUSVTD-UHFFFAOYSA-N O=C(O)O  
5265816 H2NO3+ Nitric Acid, Protonated InChI=1S/H2NO3/c2-1(3)4/h(H2,2,3,4)/q+1 AOCIUCGLIAMDFY-UHFFFAOYSA-N [N+](=O)(O)O   dihydroxy(oxo)azanium
9000360 H3CO3+ carbonic acid, protonated InChI=1S/CH3O3/c2-1(3)4/h2-4H/q+1 RZAVWYXMFRWFJR-UHFFFAOYSA-N O[C+](O)O  
463774 NH2COOH Carbamic acid InChI=1S/CH3NO2/c2-1(3)4/h2H2,(H,3,4) KXDHJXZQYSOELW-UHFFFAOYSA-N O=C(O)N   Aminoformic acid; Formic acid, amino-; Imidocarbonic acid
463774 NH2COOH Carbamic acid InChI=1S/CH3NO2/c2-1(3)4/h2H2,(H,3,4) KXDHJXZQYSOELW-UHFFFAOYSA-N O=C(O)N   Aminoformic acid; Formic acid, amino-; Imidocarbonic acid
624919 CH3ONO Methyl nitrite InChI=1S/CH3NO2/c1-4-2-3/h1H3 BLLFVUPNHCTMSV-UHFFFAOYSA-N O=NOC   Methyl ester of nitrous acid; Methyl nitrite; Methylester kyseliny dusite; Nitrous acid, methyl ester
71501 CH3COO- acetate anion InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1 QTBSBXVTEAMEQO-UHFFFAOYSA-M CC([O-])=O   acetate
71501 CH3COO- acetate anion InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1 QTBSBXVTEAMEQO-UHFFFAOYSA-M CC([O-])=O   acetate
75525 CH3NO2 Methane, nitro- InChI=1S/CH3NO2/c1-2(3)4/h1H3 LYGJENNIWJXYER-UHFFFAOYSA-N C[N](=O)=O   Methane, nitro-; Nitrocarbol; Nitrometan; Nitromethane; UN 1261
10043353 H3BO3 Boric acid InChI=1S/BH3O3/c2-1(3)4/h2-4H KGBXLFKZBHKPEV-UHFFFAOYSA-N OB(O)O   Orthoboric acid; Boracic acid; Boron hydroxide; Boron trihydroxide; boric acid
9000833 NH3COOH+ protonated Carbamic acid InChI=1S/CH3NO2/c2-1(3)4/h2H2,(H,3,4)/p+1 [NH3+]C(O)=O  
15932895 HOCH2OOH hydroxy methyl peroxide InChI=1S/CH4O3/c2-1-4-3/h2-3H,1H2 NEZWFWIACBUQMN-UHFFFAOYSA-N OCOO  
61233190 C2H4O2 1,3-dioxetane InChI=1S/C2H4O2/c1-3-2-4-1/h1-2H2 GFAJOMHUNNCCJQ-UHFFFAOYSA-N O1COC1   formaldehyde dimer; 1,3-dioxetane
61233190 C2H4O2 1,3-dioxetane InChI=1S/C2H4O2/c1-3-2-4-1/h1-2H2 GFAJOMHUNNCCJQ-UHFFFAOYSA-N O1COC1   formaldehyde dimer; 1,3-dioxetane
271587032 NH2COOH2+ Carbamic acid, O-protonated InChI=1S/CH3NO2/c2-1(3)4/h(H3,2,3,4)/p+1 OC(O)=[NH2+]  
99 HCOOHH2O Formic acid water dimer InChI=1S/CH4O3/c2-1-4-5-3/h1H,3H2 BPUQYVNUHKNCFS-UHFFFAOYSA-N OC=O.O  
102 H2OHCOOH Water formic acid dimer 1 InChI=1S/CH4O3/c2-1-4-5-3/h1,3-4H BGRYVUXAGIVYCH-UHFFFAOYSA-N OC=O.O  
113 H2OHCOOH Water formic acid dimer 2 InChI=1S/CH4O3/c2-1-4-5-3/h1-3H PCNCOKRQLSLTAM-UHFFFAOYSA-N OC=O.O  
64197 CH3COOH Acetic acid InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4) QTBSBXVTEAMEQO-UHFFFAOYSA-N CC(O)=O   Acetasol; Acetic acid; Acetic acid, glacial; Acide acetique; Acido acetico; Azijnzuur; component of Aci-Jel; Essigsaeure; Ethanoic acid; Ethylic acid; Glacial acetic acid; Kyselina octova; Methanecarboxylic acid; Octowy kwas; Vinegar acid; UN 2789; UN 2790
57136 NH2CONH2 Urea InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4) XSQUKJJJFZCRTK-UHFFFAOYSA-N NC(N)=O   Alphadrate; Aqua Care; Aquacare HP; Aquadrate; Benural 70; B-I-K; Calmurid; Carbaderm; Carbamide; Carbamide resin; Carbamimidic acid; Carbonyl Diamine; Carbonyldiamide; component of Artra Ashy Skin Cream; Isourea; Keratinamin; Mocovina; NCI-C02119; Pastaron; Prespersion, 75 urea; Pseudourea; Supercel 3000; Ureaphil; Urevert; Urea; Varioform ii; Ultra Mide; UR; Urepearl; Urea-13C; Ureophil
57136 NH2CONH2 Urea InChI=1/CH4N2O/c2-1(3)4/h(H4,2,3,4)/f/h2-3H2 XSQUKJJJFZCRTK-UBUOBULFNA-N NC(N)=O   Alphadrate; Aqua Care; Aquacare HP; Aquadrate; Benural 70; B-I-K; Calmurid; Carbaderm; Carbamide; Carbamide resin; Carbamimidic acid; Carbonyl Diamine; Carbonyldiamide; component of Artra Ashy Skin Cream; Isourea; Keratinamin; Mocovina; NCI-C02119; Pastaron; Prespersion, 75 urea; Pseudourea; Supercel 3000; Ureaphil; Urevert; Urea; Varioform ii; Ultra Mide; UR; Urepearl; Urea-13C; Ureophil
57136 NH2CONH2 Urea InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4) XSQUKJJJFZCRTK-UHFFFAOYSA-N NC(N)=O   Alphadrate; Aqua Care; Aquacare HP; Aquadrate; Benural 70; B-I-K; Calmurid; Carbaderm; Carbamide; Carbamide resin; Carbamimidic acid; Carbonyl Diamine; Carbonyldiamide; component of Artra Ashy Skin Cream; Isourea; Keratinamin; Mocovina; NCI-C02119; Pastaron; Prespersion, 75 urea; Pseudourea; Supercel 3000; Ureaphil; Urevert; Urea; Varioform ii; Ultra Mide; UR; Urepearl; Urea-13C; Ureophil
57136 NH2CONH2 Urea InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4) XSQUKJJJFZCRTK-UHFFFAOYSA-N NC(N)=O   Alphadrate; Aqua Care; Aquacare HP; Aquadrate; Benural 70; B-I-K; Calmurid; Carbaderm; Carbamide; Carbamide resin; Carbamimidic acid; Carbonyl Diamine; Carbonyldiamide; component of Artra Ashy Skin Cream; Isourea; Keratinamin; Mocovina; NCI-C02119; Pastaron; Prespersion, 75 urea; Pseudourea; Supercel 3000; Ureaphil; Urevert; Urea; Varioform ii; Ultra Mide; UR; Urepearl; Urea-13C; Ureophil
57136 NH2CONH2+ Urea cation InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)/q+1 YHOMVXWNSNZPNF-UHFFFAOYSA-N NC(N)=[O+]  
57136 NH2CONH2+ Urea cation InChI=1/CH4N2O/c2-1(3)4/h(H4,2,3,4)/q+1/f/h2-3H2 YHOMVXWNSNZPNF-UBUOBULFNA-N  
107313 CH3OCHO methyl formate InChI=1S/C2H4O2/c1-4-2-3/h2H,1H3 TZIHFWKZFHZASV-UHFFFAOYSA-N O=COC   Formiate de methyle; Formic acid, methyl ester; Methyl ester of formic acid; Methyl formate; Methyl methanoate; Methylester kyseliny mravenci; Methylformiaat; Methylformiat; Metil; Mravencan methylnaty; UN 1243
107197 C3H4O 2-Propyn-1-ol InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2 TVDSBUOJIPERQY-UHFFFAOYSA-N C#CCO   1-propyne-3-ol; propyne-3-ol; prop-2-yn-1-ol
107028 CH2CHCHO Acrolein InChI=1S/C3H4O/c1-2-3-4/h2-3H,1H2 HGINCPLSRVDWNT-UHFFFAOYSA-N O=CC=C   2-Propenal; trans-Acrolein; Acrylaldehyde; Acrylic Aldehyde; Allyl aldehyde; Aqualin; Prop-2-En-1-al; Acroleine; Propenal; Propen-1-one; Akrolein
141468 CHOCH2OH hydroxy acetaldehyde InChI=1S/C2H4O2/c3-1-2-4/h1,4H,2H2 WGCNASOHLSPBMP-UHFFFAOYSA-N O=CCO   Glycolaldehyde; Glycolic aldehyde; Hydroxyacetaldehyde; Acetaldehyde, hydroxy-; Methylol formaldehyde; Monomethylolformaldehyde; Diose; 2-hydroxyacetaldehyde
9000071 C3H4O allenol InChI=1S/C3H4O/c1-2-3-4/h3-4H,1H2 YQTVBZHHWNMNKX-UHFFFAOYSA-N C=C=CO   1,2-propadiene-1-ol; 1,2-propadiene-3-ol; propadienol; propa-1,2-dien-1-ol
5009278 C3H4O Cyclopropanone InChI=1S/C3H4O/c4-3-1-2-3/h1-2H2 VBBRYJMZLIYUJQ-UHFFFAOYSA-N O=C1CC1   Cyclopropanone
6004440 C3H4O Methylketene InChI=1S/C3H4O/c1-2-3-4/h2H,1H3 UYLUJGRCKKSWHS-UHFFFAOYSA-N O=C=CC  
3170614 C2H5OO ethylperoxy radical InChI=1S/C2H5O2/c1-2-4-3/h2H2,1H3 CGVQNDZUWCSFFT-UHFFFAOYSA-N CCO[O]  
107299 CH3CHNOH Acetaldoxime InChI=1S/C2H5NO/c1-2-3-4/h2,4H,1H3/b3-2+ FZENGILVLUJGJX-NSCUHMNNSA-N C/C=N/O   (E)-CH3CH=NOH; Acetaldehyde oxime; Acetaldoxime; Acetaldoxime,syn & anti; Aldoxime; Ethanal oxime; Ethylidenehydroxylamine; UN 2332; USAF am-5; (E)-acetaldehyde oxime
107299 CH3CHNOH Acetaldoxime InChI=1S/C2H5NO/c1-2-3-4/h2,4H,1H3/b3-2- FZENGILVLUJGJX-IHWYPQMZSA-N C/C=N\O   (E)-CH3CH=NOH; Acetaldehyde oxime; Acetaldoxime; Acetaldoxime,syn & anti; Aldoxime; Ethanal oxime; Ethylidenehydroxylamine; UN 2332; USAF am-5; (E)-acetaldehyde oxime
60355 CH3CONH2 Acetamide InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4) DLFVBJFMPXGRIB-UHFFFAOYSA-N CC(N)=O   Acetamide; Acetic acid amide; Acetimidic acid; Amid kyseliny octove; Ethanamide; Methanecarboxamide; NCI-C02108
60355 CH3CONH2 Acetamide InChI=1/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)/f/h3H2 DLFVBJFMPXGRIB-ZZOWFUDINA-N CC(N)=O   Acetamide; Acetic acid amide; Acetimidic acid; Amid kyseliny octove; Ethanamide; Methanecarboxamide; NCI-C02108
952102862 H2NCOHNH2+ urea, protonated InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)/p+1 O[C+](N)N  
67641 CH3COCH3- acetone anion InChI=1S/C3H6O/c1-3(2)4/h1-2H3/q-1 WAMWMRSVRBFDCY-UHFFFAOYSA-N [O-][C](C)C  
67641 CH3COCH3- acetone anion InChI=1/C3H6O/c1-3(2)4/h1-2H3/q-1 WAMWMRSVRBFDCY-UHFFFAOYNA-N  
67641 CH3COCH3 Acetone InChI=1S/C3H6O/c1-3(2)4/h1-2H3 CSCPPACGZOOCGX-UHFFFAOYSA-N CC(C)=O   β-Ketopropane; 2-Propanone; Acetone; Acetone oil; Allylic alcohol; Chevron acetone; Dimethyl ketone; Dimethylformaldehyde; Dimethylketal; Ketone propane; Ketone, dimethyl-; Methyl ketone; Propanone; Pyroacetic ether; Rcra waste number U002; UN 1091; UN 1090; beta-Ketopropane; propan-2-one
67641 CH3COCH3 Acetone InChI=1S/C3H6O/c1-3(2)4/h1-2H3 CSCPPACGZOOCGX-UHFFFAOYSA-N CC(C)=O   β-Ketopropane; 2-Propanone; Acetone; Acetone oil; Allylic alcohol; Chevron acetone; Dimethyl ketone; Dimethylformaldehyde; Dimethylketal; Ketone propane; Ketone, dimethyl-; Methyl ketone; Propanone; Pyroacetic ether; Rcra waste number U002; UN 1091; UN 1090; beta-Ketopropane; propan-2-one
75569 C3H6O Propylene oxide InChI=1S/C3H6O/c1-3-2-4-3/h3H,2H2,1H3 GOOHAUXETOMSMM-UHFFFAOYSA-N CC1CO1   1,2-Epoxypropane; 1,2-Propylene oxide; 2-Methyl oxirane; 2,3-Epoxypropane; 2-Methyloxiran; 3-Methyl-1,2-epoxypropane; AD 6; Epoxypropane; Ethylene oxide, methyl-; Methylethylene oxide; Methyloxirane; NCI-C50099; Oxirane, methyl-; Oxyde de propylene; Propane, 1,2-epoxy-; Propane, epoxy-; Propene oxide; Propylene epoxide; Propylene oxide; UN 1280; 2-methyloxirane
107211 C2H6O2 1,2-Ethanediol InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2 LYCAIKOWRPUZTN-UHFFFAOYSA-N OCCO   1,2-Dihydroxyethane; 1,2-Ethandiol; 1,2-Ethanediol; 2-Hydroxyethanol; Athylenglykol; Dihydroxyethane; Dowtherm SR 1; Ethane-1,2-diol; Ethanediol; Ethylene alcohol; Ethylene dihydrate; Ethylene glycol; Ethylene gycol; Fridex; Glycol; Glycol alcohol; Glygen; Lutrol 9; M.e.g.; Macrogol 400 BPC; Monoethylene glycol; Norkool; Ramp; Tescol; Ucar 17; Zerex
107186 C3H6O 2-Propen-1-ol InChI=1S/C3H6O/c1-2-3-4/h2,4H,1,3H2 XXROGKLTLUQVRX-UHFFFAOYSA-N C=CCO   1-Propen-3-ol; 1-Propenol-3; 2-Propen-1-ol; 2-Propene-1-ol; 2-Propenol; 2-Propenyl alcohol; 3-Hydroxy-1-propene; 3-Hydroxypropene; AA; Aaalcool allilco; Alcool allilco; Alcool allylique; Allilowy alkohol; Allyl al; Allyl alcohol; Allylalkohol; Allylic alcohol; Orvinylcarbinol; Propen-1-ol-3; Propenol; Propenyl alcohol; Rcra waste number P005; Shell unkrautted A; Shell Unkrauttod A; UN 1098; Vinylcarbinol; Weed drench; prop-2-en-1-ol
123386 CH3CH2CHO Propanal InChI=1S/C3H6O/c1-2-3-4/h3H,2H2,1H3 NBBJYMSMWIIQGU-UHFFFAOYSA-N CCC=O   1-Propanal; 1-Propanone; Aldehyde propionique; Methylacetaldehyde; NCI-C61029; n-Propanal; n-Propionaldehyde; n-Propylal; Propaldehyde; Propanal; Propanalaldehyde; Propanaldehyde; Propional; Propionaldehyde; Propionic aldehyde; Propylaldehyde; Propylic aldehyde; UN 1275
690028 CH3OOCH3 dimethylperoxide InChI=1S/C2H6O2/c1-3-4-2/h1-2H3 SRXOCFMDUSFFAK-UHFFFAOYSA-N COOC   Peroxide, dimethyl; Methyl peroxide; (Methylperoxy)methane
690028 CH3OOCH3 dimethylperoxide InChI=1S/C2H6O2/c1-3-4-2/h1-2H3 SRXOCFMDUSFFAK-UHFFFAOYSA-N COOC   Peroxide, dimethyl; Methyl peroxide; (Methylperoxy)methane
503300 C3H6O Oxetane InChI=1S/C3H6O/c1-2-4-3-1/h1-3H2 AHHWIHXENZJRFG-UHFFFAOYSA-N O1CCC1   1,3-Epoxypropane; 1,3-Propylene oxide; 1,3-Trimethylene oxide; α,γ-Propane oxide; Cyclooxabutane; Oxacyclobutane; Oxetan; Oxetane; Propane, 1,3-epoxy-; Trimethylenoxid; Trimethylene oxide; alpha,gamma-Propane oxide
503300 C3H6O Oxetane InChI=1S/C3H6O/c1-2-4-3-1/h1-3H2 AHHWIHXENZJRFG-UHFFFAOYSA-N O1CCC1   1,3-Epoxypropane; 1,3-Propylene oxide; 1,3-Trimethylene oxide; α,γ-Propane oxide; Cyclooxabutane; Oxacyclobutane; Oxetan; Oxetane; Propane, 1,3-epoxy-; Trimethylenoxid; Trimethylene oxide; alpha,gamma-Propane oxide
141435 HOCH2CH2NH2 monoethanolamine InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2 HZAXFHJVJLSVMW-UHFFFAOYSA-N NCCO   MEA; Ethanol, 2-amino-; -Aminoethanol; -Aminoethyl alcohol; -Hydroxyethylamine; Aminoethanol; Colamine; Ethanolamine; 2-Amino-1-Ethanol; -Ethanolamine
141435 HOCH2CH2NH2 monoethanolamine InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2 HZAXFHJVJLSVMW-UHFFFAOYSA-N NCCO   MEA; Ethanol, 2-amino-; -Aminoethanol; -Aminoethyl alcohol; -Hydroxyethylamine; Aminoethanol; Colamine; Ethanolamine; 2-Amino-1-Ethanol; -Ethanolamine
540670 CH3OC2H5 Ethane, methoxy- InChI=1S/C3H8O/c1-3-4-2/h3H2,1-2H3 XOBKSJJDNFUZPF-UHFFFAOYSA-N CCOC   Ethane, methoxy-; Ether, ethyl methyl; Ethyl methyl ether; Methane, ethoxy-; Methoxyethane; Methyl ethyl ether; ether; UN 1039
67630 CH3CHOHCH3 Isopropyl alcohol InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3 KFZMGEQAYNKOFK-UHFFFAOYSA-N CC(C)O   1-Methylethyl Alcohol; 2-Hydroxypropane; 2-Propanol; 2-Propyl alcohol; Alcohol, rubbing; Alcojel; Alcolo; Alcool isopropilico; Alcool isopropylique; Alcosolve; Alcosolve 2; Alkolave; Arquad DMCB; Avantin; Avantine; Chromar; Combi-Schutz; Dimethylcarbinol; Hartosol; Imsol A; IPA; i-Propanol; i-Propylalkohol; iso-C3H7OH; Isohol; Isopropanol; Isopropenol; Isopropyl Alcohol; Isopropyl alcohol, rubbing; iso-Propylalkohol; Lavacol; Lutosol; n-Propan-2-ol; Petrohol; PRO; Propan-2-ol; Propane, 2-hydroxy-; Propol; sec-Propanol; sec-Propyl Alcohol; Spectrar; Sterisol hand disinfectant; Takineocol; UN 1219; Visco 1152
71238 C3H7OH 1-Propanol InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3 BDERNNFJNOPAEC-UHFFFAOYSA-N CCCO   1-Propanol; 1-Propyl alcohol; 1-Hydroxypropane; Alcool propilico; Alcool propylique; Ethylcarbinol; n-C3H7OH; n-Propan-1-ol; n-Propanol; n-Propyl alcohol; n-Propyl alkohol; Optal; Osmosol extra; Propan-1-ol; Propanol; Propanol-1; Propanole; Propanolen; Propanoli; Propyl alcohol; Propylic alcohol; Propylowy alkohol; UN 1274
124 H2OCH3OCH3 water dimethylether dimer InChI=1S/C2H8O2/c1-4(2)5-3/h3H,1-2H3 WQDVWPNTHIBVKR-UHFFFAOYSA-N COC.O  
689996 C2F2 difluoroacetylene InChI=1S/C2F2/c3-1-2-4 BWTZYYGAOGUPFQ-UHFFFAOYSA-N FC#CF   Acetylene, difluoro-; Ethyne, difluoro-; Difluoroethyne; 1,2-Difluoroacetylene; 1,2-difluoroethyne
353504 CF2O Carbonic difluoride InChI=1S/CF2O/c2-1(3)4 IYRWEQXVUNLMAY-UHFFFAOYSA-N O=C(F)F   Carbon difluoride oxide; Carbon fluoride oxide; Carbon fluoride oxide (COF2); Carbon oxyfluoride; Carbonic difluoride; Carbonyl difluoride; Carbonyl fluoride; Difluoroformaldehyde; Difluorooxomethane; Difluorophosgene; Fluophosgene; Fluoroformyl fluoride; Fluorophosgene; Rcra waste number U033; UN 2417
2264213 CF3- Trifluoromethyl anion InChI=1S/CF3/c2-1(3)4/q-1 NYKUFCUBMAFLFF-UHFFFAOYSA-N F[C-](F)F  
2264213 CF3 Trifluoromethyl radical InChI=1S/CF3/c2-1(3)4 WZKSXHQDXQKIQJ-UHFFFAOYSA-N F[C](F)F   Trifluoromethyl; Trifluoromethyl radical
2264213 CF3+ Trifluoromethyl cation InChI=1S/CF3/c2-1(3)4/q+1 VRLAJHMZTGBAOE-UHFFFAOYSA-N F[C+](F)F  
7783542 NF3- Nitrogen trifluoride anion InChI=1S/F3N/c1-4(2)3/q-1 MDDMQOPEHXUQFO-UHFFFAOYSA-N F[N-](F)F  
7783542 NF3- Nitrogen trifluoride anion InChI=1S/F3N/c1-4(2)3/q-1 MDDMQOPEHXUQFO-UHFFFAOYSA-N F[N-](F)F  
7783542 NF3 Nitrogen trifluoride InChI=1S/F3N/c1-4(2)3 GVGCUCJTUSOZKP-UHFFFAOYSA-N FN(F)F   Nitrogen fluoride; Nitrogen fluoride (NF3); Nitrogen trifluoride; Perfluoroammonia; Trifluoroamine; Trifluoroammonia; UN 2451
7783542 NF3+ Nitrogen trifluoride cation InChI=1S/F3N/c1-4(2)3/q+1 GXSRSVIGHOUIDM-UHFFFAOYSA-N F[N+](F)F  
7783440 FOOF Perfluoroperoxide InChI=1S/F2O2/c1-3-4-2 REAOZOPEJGPVCB-UHFFFAOYSA-N FOOF  
7637072 BF3- Borane, trifluoro- anion InChI=1S/BF3/c2-1(3)4/q-1 ILNRIZQJTIUWSM-UHFFFAOYSA-N F[B-](F)F  
7637072 BF3- Borane, trifluoro- anion InChI=1S/BF3/c2-1(3)4/q-1 ILNRIZQJTIUWSM-UHFFFAOYSA-N F[B-](F)F  
7637072 BF3 Borane, trifluoro- InChI=1S/BF3/c2-1(3)4 WTEOIRVLGSZEPR-UHFFFAOYSA-N FB(F)F   Borane, trifluoro-; Boron fluoride; Boron fluoride (BF3); Boron trifluoride; Fluorure de bore; Trifluoroboron; UN 1008; Trifluoroborane
7637072 BF3+ boron trifluoride cation InChI=1S/BF3/c2-1(3)4/q+1 NSKPQRUNFQYXKZ-UHFFFAOYSA-N F[B+](F)F  
7637072 BF3+ boron trifluoride cation InChI=1S/BF3/c2-1(3)4/q+1 NSKPQRUNFQYXKZ-UHFFFAOYSA-N F[B+](F)F  
13812436 N2F2 (Z)-Difluorodiazene InChI=1S/F2N2/c1-3-4-2/b4-3- DUQAODNTUBJRGF-ARJAWSKDSA-N F/N=N\F   (Z)-Difluorodiazene; cis-1,2-Difluorodiimide; cis-Difluorodiazene; FNNF; Nitrogen fluoride (N2F2), (Z)-; Nitrogen fluoride, cis; (Z)-1,2-difluorodiazene
13776620 N2F2 Dinitrogen difluoride, (E)- InChI=1S/F2N2/c1-3-4-2/b4-3+ DUQAODNTUBJRGF-ONEGZZNKSA-N F/N=N/F   (E)-Difluorodiazene; (E)-N2F2; Difluorodiazene, (E)-; Dinitrogen difluoride, (E)-; FNNF; Nitrogen fluoride (N2F2), (E)-; Nitrogen fluoride, trans; trans-1,2-Difluorodiazene; trans-1,2-Difluorodiimide; trans-Difluorodiazene; (E)-1,2-difluorodiazene
75467 CHF3 Methane, trifluoro- InChI=1S/CHF3/c2-1(3)4/h1H XPDWGBQVDMORPB-UHFFFAOYSA-N FC(F)F   Arcton; Arcton 1; Carbon trifluoride; Fluoroform; Fluoryl; Freon 23; Freon F-23; Genetron 23; Halocarbon 23; Methane, trifluoro-; Methyl trifluoride; R 23; Trifluoromethane; UN 1984
75387 CH2CF2 Ethene, 1,1-difluoro- InChI=1S/C2H2F2/c1-2(3)4/h1H2 BQCIDUSAKPWEOX-UHFFFAOYSA-N FC(F)=C   1,1-Difluoroethene; 1,1-Difluoroethylene; Ethene, 1,1-difluoro-; Ethylene, 1,1-difluoro-; Genetron 1132a; Halocarbon 1132A; NCI-C60208; UN 1959; Vinylidene difluoride; Vinylidene fluoride; VDF
1630779 C2H2F2 Ethene, 1,2-difluoro-, (Z)- InChI=1S/C2H2F2/c3-1-2-4/h1-2H/b2-1- WFLOTYSKFUPZQB-UPHRSURJSA-N F/C=C\F   1,2-Difluoroethylene, (Z)-; Ethylene, 1,2-difluoro-(Z)-; Z-1,2-Difluoroethene; (Z)-1,2-difluoroethene
1630780 C2H2F2 Ethene, 1,2-difluoro-, (E)- InChI=1S/C2H2F2/c3-1-2-4/h1-2H/b2-1+ WFLOTYSKFUPZQB-OWOJBTEDSA-N F/C=C/F   Ethylene, 1,2-difluoro-, (E)-; E-1,2-Difluoroethene; 1,2-Difluoroethylene, (E)-; (E)-1,2-difluoroethene
557993 CH3COF Acetyl fluoride InChI=1S/C2H3FO/c1-2(3)4/h1H3 JUCMRTZQCZRJDC-UHFFFAOYSA-N O=C(F)C   Acetyl fluoride; Fluorid kyseliny octove; Methylcarbonyl fluoride
624726 C2H4F2 1,2-difluoroethane InChI=1S/C2H4F2/c3-1-2-4/h1-2H2 AHFMSNDOYCFEPH-UHFFFAOYSA-N FCCF   Ethylene difluoride; Ethane, 1,2-difluoro-; FC143; Freon 152; 1,2-difluoroethane
624726 C2H4F2 1,2-difluoroethane InChI=1S/C2H4F2/c3-1-2-4/h1-2H2 AHFMSNDOYCFEPH-UHFFFAOYSA-N FCCF   Ethylene difluoride; Ethane, 1,2-difluoro-; FC143; Freon 152; 1,2-difluoroethane
75376 CH3CHF2 Ethane, 1,1-difluoro- InChI=1S/C2H4F2/c1-2(3)4/h2H,1H3 NPNPZTNLOVBDOC-UHFFFAOYSA-N CC(F)F   1,1-Difluoroethane; Algofrene Type 67; Difluoroethane; Dymel 152; Ethane, 1,1-difluoro-; Ethylene fluoride; Ethylidene difluoride; Ethylidene fluoride; FC 152a; Freon 152; Freon 152a; GENETRON 100; Genetron 152a; Halocarbon 152A; Propellant 152a; R 152a; UN 1030
75241 Al(CH3)3 trimethyl aluminum InChI=1S/3CH3.Al/h3*1H3; JLTRXTDYQLMHGR-UHFFFAOYSA-N C[Al](C)C  
7784181 AlF3 Aluminum trifluoride InChI=1S/Al.3FH/h;3*1H/q+3;;;/p-3 KLZUFWVZNOTSEM-UHFFFAOYSA-K F[Al](F)F   Aluminium fluorure; Aluminum fluoride; Aluminum fluoride (AlF3); Aluminum trifluoride; Fluorid hlinity
993077 SiH(CH3)3 trimethylsilane InChI=1S/C3H10Si/c1-4(2)3/h4H,1-3H3 PQDJYEQOELDLCP-UHFFFAOYSA-N C[SiH](C)C  
14835144 SiF3 Silicon trifluoride radical InChI=1S/F3Si/c1-4(2)3 F[Si](F)F   trifluorosilyl radical
14835144 SiF3+ Silicon trifluoride cation InChI=1S/F3Si/c1-4(2)3/q+1 F[Si+](F)F  
12185103 P4 Phosphorus tetramer InChI=1S/P4/c1-2-3(1)4(1)2/t1-,2+,3-,4+ OBSZRRSYVTXPNB-GNSDDBTRSA-N P12P3P1P23   Phosphorus; Phosphorus tetramer; tricyclo[1.1.0.02,4]tetraphosphine
7783553 PF3 Phosphorus trifluoride InChI=1S/F3P/c1-4(2)3 WKFBZNUBXWCCHG-UHFFFAOYSA-N FP(F)F   Phosphorous fluoride; Phosphorous-trifluoride-; Phosphorus fluoride; Phosphorus trifluoride; Phosphorus(III) fluoride; TL 75; Trifluorophosphine; Trifluorophosphane
7446119 SO3- Sulfur trioxide anion InChI=1S/O3S/c1-4(2)3/q-1 HMIIOTJRQSFDBQ-UHFFFAOYSA-N [O-][S]([O])[O]  
7446119 SO3- Sulfur trioxide anion InChI=1S/O3S/c1-4(2)3/q-1 HMIIOTJRQSFDBQ-UHFFFAOYSA-N [O-][S]([O])[O]  
7446119 SO3 Sulfur trioxide InChI=1S/O3S/c1-4(2)3 AKEJUJNQAAGONA-UHFFFAOYSA-N O=S(=O)=O   Sulfan; Sulfur oxide (SO3); Sulfur trioxide; Sulfur trioxide, stabilized; Sulfuric anhydride; Sulfuric oxide; UN 1829
7446119 SO3+ Sulfur trioxide cation InChI=1S/O3S/c1-4(2)3/q+1 OCAJGPLXGNEGFT-UHFFFAOYSA-N [O][S+]([O])[O]  
104267223 HSO3 HOSO2 InChI=1S/HO3S/c1-4(2)3/h(H,1,2) XPRXJFAFJFZWTC-UHFFFAOYSA-N O[S@]([O])=O  
7782992 H2SO3 Sulfurous acid InChI=1S/H2O3S/c1-4(2)3/h(H2,1,2,3) LSNNMFCWUKXFEE-UHFFFAOYSA-N O=S(O)O  
7782992 H2SO3 Sulfurous acid InChI=1S/H2O3S/c1-4(2)3/h(H2,1,2,3) LSNNMFCWUKXFEE-UHFFFAOYSA-N O=S(O)O  
62566 NH2CSNH2 Thiourea InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4) UMGDCJDMYOKAJW-UHFFFAOYSA-N NC(N)=S   β-Thiopseudourea; 2-Thiopseudourea; 2-Thiourea; Isothiourea; Pseudothiourea; Pseudourea, 2-thio-; Rcra waste number U219; Sulourea; Thiocarbamide; Thiocarbonic acid diamide; Thiomocovina; Thiourea; Thiuronium; THU; Urea, 2-thio-; USAF ek-497; Tsizp 34; UN 2877; Urea, thio-; beta-Thiopseudourea
67685 CH3SOCH3 Dimethyl sulfoxide InChI=1S/C2H6OS/c1-4(2)3/h1-2H3 IAZDPXIOMUYVGZ-UHFFFAOYSA-N C[S](C)=O   A 10846; Deltan; Demasorb; Demavet; Demeso; Demsodrox; Dermasorb; Dimethyl Sulfoxide; Dimethyl sulfoxixde; Dimethyl Sulphoxide; Dimethyl sulpoxide; Dimexide; Dipirartril-tropico; DMS 70; DMS 90; DMSO; Dolicur; Doligur; Domoso; Dromisol; Durasorb; Gamasol 90; Hyadur; Infiltrina; M 176; Methane, sulfinylbis-; Methyl sulfoxide; Methylsulfinylmethane; NSC-763; Rimso 50; Somipront; SQ 9453; SQ 9453 roxyethane; Sulfinylbis[Methane]; Syntexan; Topsym; (methylsulfinyl)methane
624920 CH3SSCH3 Disulfide, dimethyl InChI=1S/C2H6S2/c1-3-4-2/h1-2H3 WQOXQRCZOLPYPM-UHFFFAOYSA-N CSSC   2,3-Dithiabutane; (Methyldithio)methane; Dimethyl disulfide; Dimethyl disulphide; Disulfide, dimethyl; Methyl disulfide; UN 2381; 1,2-dimethyldisulfane
540636 CH2SHCH2SH 1,2-Ethanedithiol InChI=1S/C2H6S2/c3-1-2-4/h3-4H,1-2H2 VYMPLPIFKRHAAC-UHFFFAOYSA-N SCCS   α-Ethylene dimercaptan; 1,2-Dimercaptoethane; 1,2-Ethanedithiol; 1,2-Ethanethiol; A-ethylene dimercaptan; Dithioethyleneglycol; Dithioglycol; Ethanedithiol; Ethyl hydropersulfide; Ethylene dithioglycol; Ethylene glycol, dithio-; Ethylenedimercaptan; Ethylenedithiol; s-Ethylene dimercaptan; alpha-Ethylene dimercaptan; ethane-1,2-dithiol
287274 C3H6S Thietane InChI=1S/C3H6S/c1-2-4-3-1/h1-3H2 XSROQCDVUIHRSI-UHFFFAOYSA-N S1CCC1   Propane, 1,3-epithio-; Thiacyclobutane; Thietane; Trimethylene sulfide
1072431 C3H6S Thiirane, methyl- InChI=1S/C3H6S/c1-3-2-4-3/h3H,2H2,1H3 MBNVSWHUJDDZRH-UHFFFAOYSA-N C[C@@H]1SC1   1,2-Epithiopropane; 2-Methylthiacyclopropane; 2-Methylthiirane; Methylthiirane; Propane, 1,2-epithio-; Propene sulfide; Propylene episulfide; Propylene sulfide; Propylene sulphide; Thiirane, 2-methyl-; Thiirane, methyl-
4756052 CH3CSCH3 Thioacetone InChI=1S/C3H6S/c1-3(2)4/h1-2H3 JTNXQVCPQMQLHK-UHFFFAOYSA-N S=C(C)C  
624895 CH3SCH2CH3 Ethane, (methylthio)- InChI=1S/C3H8S/c1-3-4-2/h3H2,1-2H3 WXEHBUMAEPOYKP-UHFFFAOYSA-N CCSC   (Methylthio)ethane; 2-Thiabutane; Ethane, (methylthio)-; Ethyl methyl sulfide; Ethyl methyl sulphide; Methyl ethyl sulfide; Sulfide, ethyl methyl; ethyl(methyl)sulfane
75332 CH3CHSHCH3 2-Propanethiol InChI=1S/C3H8S/c1-3(2)4/h3-4H,1-2H3 KJRCEJOSASVSRA-UHFFFAOYSA-N CC(C)S   1-Methylethanethiol; 2-Isopropyl-6-methylphenyl isocyanate; 2-Mercaptopropane; 2-Propanethiol; 2-Propylmercaptan; iso-C3H7SH; Isopropanethiol; Isopropyl mercaptan; Isopropylthiol; Propanethiol-(2); UN 2402; propane-2-thiol
107039 C3H7SH 1-Propanethiol InChI=1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3 SUVIGLJNEAMWEG-UHFFFAOYSA-N CCCS   1-Propanethiol; 1-Propanethoil; 1-Propyl mercaptan; 3-Mercaptopropanol; n-C3H7SH; n-Propyl mercaptan; Propane-1-thiol; Propanethiol; Propyl mercaptan; UN 2402
7783428 F2SO Thionyl Fluoride InChI=1S/F2OS/c1-4(2)3 LSJNBGSOIVSBBR-UHFFFAOYSA-N O=S(F)F   Sulfur difluoride oxide; Sulfurous oxyfluoride; Thionyl difluoride; Sulfur difluoride monoxide; sulfurous difluoride
30937383 SF3 Sulfur trifluoride InChI=1S/F3S/c1-4(2)3 PSCXEUSWZWRCMQ-UHFFFAOYSA-N F[S](F)F  
30937383 SF3 Sulfur trifluoride InChI=1S/F3S/c1-4(2)3 PSCXEUSWZWRCMQ-UHFFFAOYSA-N F[S](F)F  
13709358 FSSF Difluorodisulfane InChI=1S/F2S2/c1-3-4-2 DKDSFVCSLPKNPV-UHFFFAOYSA-N FSSF  
16860994 S2F2 Thio-thionyl fluoride InChI=1S/F2S2/c1-4(2)3 KBYVSSUWTLBZTB-UHFFFAOYSA-N S=S(F)F  
19165345 SiCl3 trichlorosilyl radical InChI=1S/Cl3Si/c1-4(2)3 PPDADIYYMSXQJK-UHFFFAOYSA-N Cl[Si](Cl)Cl  
19165345 SiCl3+ trichlorosilyl cation InChI=1S/Cl3Si/c1-4(2)3/q+1 NYQBETHNPQLDSX-UHFFFAOYSA-N Cl[Si+](Cl)Cl  
23594889 ClO3- chlorate anion InChI=1S/ClHO3/c2-1(3)4/h(H,2,3,4)/p-1 XTEGARKTQYYJKE-UHFFFAOYSA-M O=Cl([O-])=O  
13814658 AlF2Cl Aluminum chloride difluoride InChI=1S/Al.ClH.2FH/h;3*1H/q+3;;;/p-3 AAYWCFPMITZDSH-UHFFFAOYSA-K F[Al](Cl)F   Aluminum chloride fluoride
13497966 AlFCl2 Aluminum dichloride fluoride InChI=1S/Al.2ClH.FH/h;3*1H/q+3;;;/p-3 JNGNDYHADNWZFG-UHFFFAOYSA-K F[Al](Cl)Cl   Aluminum chloride fluoride; aluminum dichloride fluoride
13444901 ClNO2 Nitryl chloride InChI=1S/ClNO2/c1-2(3)4 HVZWVEKIQMJYIK-UHFFFAOYSA-N ClN(=O)=O   Nitryl chloride
12258989 Na2Cl2 Disodium dichloride InChI=1S/2Cl.2Na SJUGNKORWBGDHO-UHFFFAOYSA-N [Na]1Cl[Na]Cl1   Sodium chloride; Sodium chloride dimer
12292238 ClOOCl Dichlorine dioxide InChI=1S/Cl2O2/c1-3-4-2 MAYPHUUCLRDEAZ-UHFFFAOYSA-N ClOOCl  
10025679 S2Cl2 Disulfur dichloride InChI=1S/Cl2S2/c1-3-4-2 PXJJSXABGXMUSU-UHFFFAOYSA-N ClSSCl   Sulfur chloride; Thiosulfurous dichloride; Chlorschwefel; Sulfur subchloride; Chlorosulfane; hypochlorous dithioperoxyanhydride
10025851 NCl3 nitrogen trichloride InChI=1S/Cl3N/c1-4(2)3 QEHKBHWEUPXBCW-UHFFFAOYSA-N ClN(Cl)Cl   Nitrogen chloride; Agene; Chlorine nitride; Trichloramine; Trichlorine nitride; Nitrogen trichloride
10294345 BCl3 Borane, trichloro- InChI=1S/BCl3/c2-1(3)4 FAQYAMRNWDIXMY-UHFFFAOYSA-N ClB(Cl)Cl   Borane, trichloro-; Boron chloride; Boron chloride (BCl3); Boron trichloride; Chlorure de bore; Trichloroboron; Trichloroborane; UN 1741
65283989 ClONO chlorine nitrite InChI=1S/ClNO2/c1-4-2-3 NXRVFVBNLWGOCL-UHFFFAOYSA-N ClON=O   Nitrosyl hypochlorite; hypochlorous nitrous anhydride; chlorine nitrite
7790912 ClF3 Chlorine trifluoride InChI=1S/ClF3/c2-1(3)4 JOHWNGGYGAVMGU-UHFFFAOYSA-N FCl(F)F   Chlorine fluoride; Chlorine fluoride (ClF3); Chlorine trifluoride; Chlorotrifluoride; Trifluorure de chlore; UN 1749
7790912 ClF3 Chlorine trifluoride InChI=1S/ClF3/c2-1(3)4 JOHWNGGYGAVMGU-UHFFFAOYSA-N FCl(F)F   Chlorine fluoride; Chlorine fluoride (ClF3); Chlorine trifluoride; Chlorotrifluoride; Trifluorure de chlore; UN 1749
7446700 AlCl3 Aluminum trichloride InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3 VSCWAEJMTAWNJL-UHFFFAOYSA-K Cl[Al](Cl)Cl   Alluminio(cloruro di); Aluminium trichloride; Aluminium, (chlorure d'); Aluminiumchlorid; Aluminum chloride; Aluminum chloride (1:3); Aluminum chloride (AlCl3); Aluminum trichloride; Chlorure d'aluminium; Drysol; NSC 143016; PAC (salt); Pearsall; Trichloroaluminum; UN 1726; UN 2581
7572294 C2Cl2 dichloroacetylene InChI=1S/C2Cl2/c3-1-2-4 ZMJOVJSTYLQINE-UHFFFAOYSA-N ClC#CCl  
7572294 C2Cl2+ dichloroacetylene cation InChI=1S/C2Cl2/c3-1-2-4/q+1 STFJFHBZJXWFDE-UHFFFAOYSA-N ClC#[C+]Cl  
7719097 SOCl2 thionyl chloride InChI=1S/Cl2OS/c1-4(2)3 FYSNRJHAOHDILO-UHFFFAOYSA-N O=S(Cl)Cl   Sulfinyl chloride; Sulfur chloride oxide; Sulfurous dichloride; Sulfurous oxychloride; Thionyl dichloride; Sulfinyl dichloride; Sulfur oxychloride
7719122 PCl3 Phosphorus trichloride InChI=1S/Cl3P/c1-4(2)3 FAIAAWCVCHQXDN-UHFFFAOYSA-N ClP(Cl)Cl   Chloride of phosphorus; Fosforo(tricloruro di); Fosfortrichloride; Phosphore(trichlorure de); Phosphorous chloride; Phosphorous trichloride; Phosphortrichlorid; Phosphorus chloride; Phosphorus trichloride; Phosphorus(III) chloride; Trojchlorek fosforu; UN 1809; trichlorophosphane; tricholorphosphine
3170807 CCl3- Trichloromethyl anion InChI=1S/CCl3/c2-1(3)4/q-1 PMBRBOODEWULOI-UHFFFAOYSA-N Cl[C-](Cl)Cl  
3170807 CCl3 Trichloromethyl radical InChI=1S/CCl3/c2-1(3)4 ZBZJXHCVGLJWFG-UHFFFAOYSA-N Cl[C](Cl)Cl   Trichloromethyl; Trichloromethyl radical
3170807 CCl3+ Trichloromethyl cation InChI=1S/CCl3/c2-1(3)4/q+1 YDTAHIYKMNZFBE-UHFFFAOYSA-N Cl[C+](Cl)Cl  
75445 CCl2O Phosgene InChI=1S/CCl2O/c2-1(3)4 YGYAWVDWMABLBF-UHFFFAOYSA-N ClC(Cl)=O   Carbon dichloride oxide; Carbon oxychloride; Carbone; Carbonic chloride; Carbonic dichloride; Carbonio; Carbonyl chloride; Carbonyl dichloride; Carbonylchlorid; CG; Chloroformyl chloride; Fosgeen; Fosgen; Fosgene; Koolstofoxychloride; NCI-C60219; Phosgen; Phosgene; Rcra waste number P095; UN 1076
463718 Cl2CS Thiophosgene InChI=1S/CCl2S/c2-1(3)4 ZWZVWGITAAIFPS-UHFFFAOYSA-N S=C(Cl)Cl   Carbonothioic dichloride; Carbon chlorosulfide; Carbonic dichloride, thio-; Dichlorothiocarbonyl; Thiocarbonyl chloride; Thiocarbonyl dichloride; Phosgene, thio-; Thiocarbonic dichloride; Thiofosgen; Thiokarbonylchlorid; UN 2474; Dichlorothioformaldehyde
353491 COFCl Carbonic chloride fluoride InChI=1S/CClFO/c2-1(3)4 OXVVNXMNLYYMOL-UHFFFAOYSA-N O=C(Cl)F   Carbonyl chloride fluoride; Carbonyl chlorofluoride; carbonic chloride fluoride
75456 CHF2Cl difluorochloromethane InChI=1S/CHClF2/c2-1(3)4/h1H VOPWNXZWBYDODV-UHFFFAOYSA-N FC(F)Cl   Methane, chlorodifluoro-; Chlorodifluoromethane; Difluoromonochloromethane; Freon 22; Genetron 22; Monochlorodifluoromethane; R 22
75434 CHFCl2 fluorodichloromethane InChI=1S/CHCl2F/c2-1(3)4/h1H UMNKXPULIDJLSU-UHFFFAOYSA-N FC(Cl)Cl   Methane, dichlorofluoro-; Dichlorofluoromethane; Dichloromonofluoromethane; Freon 21; Genetron 21; Monofluorodichloromethane; R 21; UN 1029
67663 CHCl3 Chloroform InChI=1S/CHCl3/c2-1(3)4/h1H HEDRZPFGACZZDS-UHFFFAOYSA-N ClC(Cl)Cl   Chloroform; Chloroforme; Cloroformio; Formyl trichloride; Freon 20; Methane trichloride; Methane, trichloro-; Methenyl trichloride; Methyl trichloride; NCI-C02686; R 20; R 20 (refrigerant); Rcra waste number U044; TCM; Trichloormethaan; Trichloromethane; Trichlormethan; Trichloroform; Triclorometano; UN 1888
865496 CDCl3 trichloromethane-d InChI=1S/CHCl3/c2-1(3)4/h1H/i1D HEDRZPFGACZZDS-MICDWDOJSA-N ClC(Cl)Cl  
7790934 HClO3 Chloric Acid InChI=1S/ClHO3/c2-1(3)4/h(H,2,3,4) XTEGARKTQYYJKE-UHFFFAOYSA-N OCl([O])[O]  
7790934 HClO3 Chloric Acid InChI=1S/ClHO3/c2-1(3)4/h(H,2,3,4) XTEGARKTQYYJKE-UHFFFAOYSA-N OCl([O])[O]  
10025782 SiHCl3 Trichlorosilane InChI=1S/Cl3HSi/c1-4(2)3/h4H ZDHXKXAHOVTTAH-UHFFFAOYSA-N Cl[SiH](Cl)Cl   Silane, trichloro-; Silici-chloroforme; Siliciumchloroform; Silicochloroform; Trichloorsilaan; Trichloromonosilane; Trichlorosilane; Triclorosilano; Trichlorsilan; UN 1295
75354 CH2CCl2 Ethene, 1,1-dichloro- InChI=1S/C2H2Cl2/c1-2(3)4/h1H2 LGXVIGDEPROXKC-UHFFFAOYSA-N ClC(Cl)=C   1,1-DCE; 1,1-Dichloroethene; 1,1-Dichloroethylene; Chlorure de vinylidene; Ethene, 1,1-dichloro-; Ethylene, 1,1-dichloro-; NCI-C54262; Rcra waste number U078; Sconatex; VDC; Vinylidine chloride; Vinylidene dichloride; Vinylidene chloride
156592 CHClCHCl Ethene, 1,2-dichloro-, (Z)- InChI=1S/C2H2Cl2/c3-1-2-4/h1-2H/b2-1- KFUSEUYYWQURPO-UPHRSURJSA-N Cl/C=C\Cl   1,cis-2-Dichloroethene; 1,2-cis-Dichloroethene; 1,2-cis-Dichloroethylene; (Z)-1,2-Dichloroethene; (Z)-1,2-Dichloroethylene; (Z)-CHCl=CHCl; Acetylene dichloride, cis-; cis-1,2-Dichloroethene; cis-1,2-Dichloroethylene; cis-Di-1,2-Chloroethylene; cis-Dichloroethylene; cis-Dichloromethylene; Dichloroethylene, cis-; Ethene, 1,2-dichloro-, (Z)-; Ethylene, 1,2-dichloro-, (Z)-; 1,2-dichloroethylene
156605 CHClCHCl Ethene, 1,2-dichloro-, (E)- InChI=1S/C2H2Cl2/c3-1-2-4/h1-2H/b2-1+ KFUSEUYYWQURPO-OWOJBTEDSA-N Cl/C=C/Cl   1,trans-2-Dichloroethene; 1,2-trans-Dichloroethene; 1,2-trans-Dichloroethylene; (E)-1,2-Dichloroethene; (E)-1,2-Dichloroethylene; (E)-CHCl=CHCl; Acetylene dichloride, trans-; Dichloroethylene, trans-; Ethene, 1,2-dichloro-, (E)-; Ethylene, 1,2-dichloro-, (E)-; Rcra waste number U079; trans-1,2-Dichloroethene; trans-1,2-Dichloroethylene; trans-Acetylene dichloride; trans-Di-1,2-Chloroethylene; trans-Dichloroethylene; 1,2-dichloroethylene
75365 CH3COCl Acetyl Chloride InChI=1S/C2H3ClO/c1-2(3)4/h1H3 WETWJCDKMRHUPV-UHFFFAOYSA-N CC(Cl)=O   Acetic acid chloride; Acetic chloride; Acetyl chloride; Ethanoyl chloride; Rcra waste number U006; UN 1717
107200 CH2ClCHO chloroacetaldehyde InChI=1S/C2H3ClO/c3-1-2-4/h2H,1H2 QSKPIOLLBIHNAC-UHFFFAOYSA-N O=CCCl   Acetaldehyde, chloro-; Monochloroacetaldehyde; 2-Chloro-1-ethanal; 2-Chloroacetaldehyde; Chloroethanal; 2-Chloroethanal; UN 2232
107200 CH2ClCHO chloroacetaldehyde InChI=1S/C2H3ClO/c3-1-2-4/h2H,1H2 QSKPIOLLBIHNAC-UHFFFAOYSA-N O=CCCl   Acetaldehyde, chloro-; Monochloroacetaldehyde; 2-Chloro-1-ethanal; 2-Chloroacetaldehyde; Chloroethanal; 2-Chloroethanal; UN 2232
107062 CH2ClCH2Cl Ethane, 1,2-dichloro- InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2 WSLDOOZREJYCGB-UHFFFAOYSA-N ClCCCl   α,β-Dichloroethane; 1,2-Bichloroethane; 1,2-DCE; 1,2-Dichloorethaan; 1,2-Dichlor-aethan; 1,2-Dichlorethane; 1,2-Dichloroethane; 1,2-Dicloroetano; 1,2-Ethylene dichloride; Aethylenchlorid; Bichlorure D'ethylene; Borer sol; Brocide; Chlorure D'ethylene; Cloruro di ethene; Destruxol borer-sol; Dichloremulsion; Di-chlor-mulsion; Dichloro-1,2-ethane; Dichloroethylene; Dutch liquid; Dutch oil; EDC; ENT 1,656; Ethane dichloride; Ethane, 1,2-dichloro-; Ethyleendichloride; Ethylene chloride; Ethylene dichloride; Freon 150; Glycol dichloride; NCI-C00511; Rcra waste number U077; s-Dichloroethane; sym-Dichloroethane; UN 1184; alpha,beta-Dichloroethane; dichloroethane
107062 CH2ClCH2Cl Ethane, 1,2-dichloro- InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2 WSLDOOZREJYCGB-UHFFFAOYSA-N ClCCCl   α,β-Dichloroethane; 1,2-Bichloroethane; 1,2-DCE; 1,2-Dichloorethaan; 1,2-Dichlor-aethan; 1,2-Dichlorethane; 1,2-Dichloroethane; 1,2-Dicloroetano; 1,2-Ethylene dichloride; Aethylenchlorid; Bichlorure D'ethylene; Borer sol; Brocide; Chlorure D'ethylene; Cloruro di ethene; Destruxol borer-sol; Dichloremulsion; Di-chlor-mulsion; Dichloro-1,2-ethane; Dichloroethylene; Dutch liquid; Dutch oil; EDC; ENT 1,656; Ethane dichloride; Ethane, 1,2-dichloro-; Ethyleendichloride; Ethylene chloride; Ethylene dichloride; Freon 150; Glycol dichloride; NCI-C00511; Rcra waste number U077; s-Dichloroethane; sym-Dichloroethane; UN 1184; alpha,beta-Dichloroethane; dichloroethane
75343 CH3CHCl2 Ethane, 1,1-dichloro- InChI=1S/C2H4Cl2/c1-2(3)4/h2H,1H3 SCYULBFZEHDVBN-UHFFFAOYSA-N CC(Cl)Cl   1,1-Dichloorethaan; 1,1-Dichloraethan; 1,1-Dichlorethane; 1,1-Dichloroethane; 1,1-Dicloroetano; Aethylidenchlorid; Assymmetrical Dichloroethane; Chlorinated hydrochloric ether; Chlorure D'ethylidene; Cloruro di etilidene; Dichloromethylmethane; Ethane, 1,1-dichloro-; Ethylidene chloride; Ethylidene dichloride; NCI-C04535; Rcra waste number U076; UN 2362; dichloroethane
762505 CH2FCH2Cl Ethane, 1-chloro-2-fluoro- InChI=1S/C2H4ClF/c3-1-2-4/h1-2H2 VEZJSKSPVQQGIS-UHFFFAOYSA-N ClCCF   1-Chloro-2-fluoroethane; Monofluoromonochloroethane; HCFC 151
1615754 CH3CHFCl Ethane, 1-chloro-1-fluoro- InChI=1S/C2H4ClF/c1-2(3)4/h2H,1H3 YACLCMMBHTUQON-UHFFFAOYSA-N C[C@H](Cl)F   1-Chloro-1-fluoroethane; 1-Chlorofluoroethane; Ethane, 1-chloro-1-fluoro-; Freon 151; Monochloromonofluoroethane
107051 C3H5Cl 1-Propene, 3-chloro- InChI=1S/C3H5Cl/c1-2-3-4/h2H,1,3H2 OSDWBNJEKMUWAV-UHFFFAOYSA-N C=CCCl   Allyl chloride; Propene, 3-chloro-; 1-Chloro-2-propene; 2-Propenyl chloride; 3-Chloro-1-propene; 3-Chloropropene; 3-Chloropropylene; Chloroallylene; 3-Chloroprene; Allylchlorid; Chlorallylene; 3-Chloro-1-propylene; 1-Chloropropene-2; 3-Chloropropene-1; Chloropropene 3-Chlorpropen; 3-chloroprop-1-ene
16136848 C3H5Cl 1-chloro-1-propene(Z) InChI=1S/C3H5Cl/c1-2-3-4/h2-3H,1H3/b3-2- OWXJKYNZGFSVRC-IHWYPQMZSA-N C/C=C\Cl   1-Propene, 1-chloro-, (Z)-; cis-1-Chloropropene; Propene, 1-chloro-, (Z)-; cis-1-Chloro-1-Propene; 1-Chloro-propene; (Z)-1-Chloro-1-propene; (Z)-1-chloroprop-1-ene
16136859 C3H5Cl 1-chloro-1-propene(E) InChI=1S/C3H5Cl/c1-2-3-4/h2-3H,1H3/b3-2+ OWXJKYNZGFSVRC-NSCUHMNNSA-N C/C=C/Cl   1-Propene, 1-chloro-, (E)-; trans-1-Chloropropene; Propene, 1-chloro-, (E)-; (E)-1-Chloro-1-propene; trans-1-Chloro-1-Propene; trans-1-Propenyl chloride; (E)-1-chloroprop-1-ene
75296 CH3CHClCH3 Propane, 2-chloro- InChI=1S/C3H7Cl/c1-3(2)4/h3H,1-2H3 ULYZAYCEDJDHCC-UHFFFAOYSA-N CC(C)Cl   2-Chloropropane; 2-Propyl chloride; Chlorodimethylmethane; iso-C3H7Cl; Isoprid; Isopropyl chloride; Narcosop; Propane, 2-chloro-; sec-Propyl chloride; UN 2356
540545 CH2ClCH2CH3 Propane, 1-chloro- InChI=1S/C3H7Cl/c1-2-3-4/h2-3H2,1H3 SNMVRZFUUCLYTO-UHFFFAOYSA-N CCCCl   1-Chloropropane; Chloropropane; n-C3H7Cl; n-Propyl chloride; Propane, 1-chloro-; Propyl chloride; UN 1278
540545 CH2ClCH2CH3 Propane, 1-chloro- InChI=1S/C3H7Cl/c1-2-3-4/h2-3H2,1H3 SNMVRZFUUCLYTO-UHFFFAOYSA-N CCCCl   1-Chloropropane; Chloropropane; n-C3H7Cl; n-Propyl chloride; Propane, 1-chloro-; Propyl chloride; UN 1278
13709472 ScF3 Scandium trifluoride InChI=1S/3FH.Sc/h3*1H;/q;;;+3/p-3 OEKDNFRQVZLFBZ-UHFFFAOYSA-K F[Sc](F)F   Scandium(III) Fluoride
13450903 GaCl3 Gallium trichloride InChI=1S/3ClH.Ga/h3*1H;/q;;;+3/p-3 UPWPDUACHOATKO-UHFFFAOYSA-K Cl[Ga](Cl)Cl  
7783519 GaF3 Gallium trifluoride InChI=1S/3FH.Ga/h3*1H;/q;;;+3/p-3 WXXZSFJVAMRMPV-UHFFFAOYSA-K F[Ga](F)F  
12187085 As4 Arsenic tetramer InChI=1S/As4/c1-2-3(1)4(1)2/t1-,2+,3-,4+ UYVQXFOBKTWZCW-GNSDDBTRSA-N [As]12[As]3[As]1[As]23  
593884 As(CH3)3 trimethyl arsine InChI=1S/C3H9As/c1-4(2)3/h1-3H3 HTDIUWINAKAPER-UHFFFAOYSA-N C[As](C)C  
7784341 AsCl3 Arsenous trichloride 1S/AsCl3/c2-1(3)4 OEYOHULQRFXULB-UHFFFAOYSA-N Cl[As](Cl)Cl   Arsenic trichloride; Arsenic(III) chloride; Arsenous chloride; Arsenic chloride; Arsenic butter; Arsenious chloride; UN 1560; Trichloroarsine; Chlorure arsenieux; Chlorure d'arsenic
7784352 AsF3 Arsenic trifluoride InChI=1S/AsF3/c2-1(3)4 JCMGUODNZMETBM-UHFFFAOYSA-N F[As](F)F   Arsenous fluoride; Arsenic fluoride; Trifluoroarsine; Arsenious fluoride; Arsenic(III) fluoride
13768860 SeO3 selenium trioxide InChI=1S/O3Se/c1-4(2)3 VFLXBUJKRRJAKY-UHFFFAOYSA-N [O][Se]([O])[O]  
13768860 SeO3 selenium trioxide InChI=1S/O3Se/c1-4(2)3 VFLXBUJKRRJAKY-UHFFFAOYSA-N [O][Se]([O])[O]  
7791233 SeOCl2 selenium oxychloride InChI=1S/Cl2OSe/c1-4(2)3 LIRMPIXWGWLNND-UHFFFAOYSA-N [O][Se](Cl)Cl  
7789608 PBr3 Phosphorus tribromide InChI=1S/Br3P/c1-4(2)3 IPNPIHIZVLFAFP-UHFFFAOYSA-N BrP(Br)Br   Tribromophosphane; Tribromophosphine
7787715 BrF3 Bromine trifluoride InChI=1S/BrF3/c2-1(3)4 FQFKTKUFHWNTBN-UHFFFAOYSA-N FBr(F)F   Bromine fluoride; Bromine trifluoride
593953 COBr2 Carbonic dibromide InChI=1S/CBr2O/c2-1(3)4 MOIPGXQKZSZOQX-UHFFFAOYSA-N O=C(Br)Br  
10294334 BBr3 Boron tribromide InChI=1S/BBr3/c2-1(3)4 ILAHWRKJUDSMFH-UHFFFAOYSA-N BrB(Br)Br   tribromoborane
15162900 NBr3 Nitrogen Tribromide InChI=1S/Br3N/c1-4(2)3 UQQALTRHPDPRQC-UHFFFAOYSA-N BrN(Br)Br   Tribromoamine
96607022 BrONO Bromine nitrite InChI=1S/BrNO2/c1-4-2-3 ORQUYLREYNLBRU-UHFFFAOYSA-N O=NOBr  
96607022 BrONO Bromine nitrite InChI=1S/BrNO2/c1-4-2-3 ORQUYLREYNLBRU-UHFFFAOYSA-N O=NOBr  
124481 CHClBr2 Methane, dibromochloro- InChI=1S/CHBr2Cl/c2-1(3)4/h1H GATVIKZLVQHOMN-UHFFFAOYSA-N BrC(Br)Cl   Chlorodibromomethane; Dibromochloromethane; Methane, chlorodibromo-; Monochlorodibromomethane; Dibromomonochloromethane; Chlorobromoform
75252 CHBr3 bromoform InChI=1S/CHBr3/c2-1(3)4/h1H DIKBFYAXUHHXCS-UHFFFAOYSA-N BrC(Br)Br   Methenyl tribromide; Methane, tribromo-; Bromoforme; Tribromomethane; Tribromometan; bromoform
75274 CHBrCl2 Methane, bromodichloro- InChI=1S/CHBrCl2/c2-1(3)4/h1H FMWLUWPQPKEARP-UHFFFAOYSA-N ClC(Br)Cl   Bromodichloromethane; Dichlorobromomethane; Dichloromonobromomethane; Monobromodichloromethane
1511622 CHBrF2 Methane, bromodifluoro- InChI=1S/CHBrF2/c2-1(3)4/h1H GRCDJFHYVYUNHM-UHFFFAOYSA-N BrC(F)F   Bromodifluoromethane; Difluorobromomethane
106934 CH2BrCH2Br Ethane, 1,2-dibromo- InChI=1S/C2H4Br2/c3-1-2-4/h1-2H2 PAAZPARNPHGIKF-UHFFFAOYSA-N BrCCBr   a,-Dibromoethane; sym-Dibromoethane; Ethylene bromide; Ethylene dibromide; 1,2-Dibromoethane; Dibromoethane; NCI-C00522; Rcra waste number U067; UN 1605
106934 CH2BrCH2Br Ethane, 1,2-dibromo- InChI=1S/C2H4Br2/c3-1-2-4/h1-2H2 PAAZPARNPHGIKF-UHFFFAOYSA-N BrCCBr   a,-Dibromoethane; sym-Dibromoethane; Ethylene bromide; Ethylene dibromide; 1,2-Dibromoethane; Dibromoethane; NCI-C00522; Rcra waste number U067; UN 1605
106945 CH3CH2CH2Br n-propyl bromide InChI=1S/C3H7Br/c1-2-3-4/h2-3H2,1H3 CYNYIHKIEHGYOZ-UHFFFAOYSA-N CCCBr  
75263 CH3CHBrCH3 i-propyl bromide InChI=1S/C3H7Br/c1-3(2)4/h3H,1-2H3 NAMYKGVDVNBCFQ-UHFFFAOYSA-N CC(C)Br   Isopropyl bromide; Propane, 2-bromo-; 2-Bromopropane; sec-Propyl bromide; UN 2344
2143535 C5H5 cyclopentadienyl radical InChI=1S/C5H5/c1-2-4-5-3-1/h1-5H HPYIUKIBUJFXII-UHFFFAOYSA-N [CH]1C=CC=C1  
2143535 C5H5 cyclopentadienyl radical InChI=1S/C5H5/c1-2-4-5-3-1/h1-5H HPYIUKIBUJFXII-UHFFFAOYSA-N [CH]1C=CC=C1  
12127832 C5H5- cylopentadienyl anion InChI=1S/C5H5/c1-2-4-5-3-1/h1-5H/q-1 SINKOGOPEQSHQD-UHFFFAOYSA-N C1=CC=C[CH-]1   cyclopentadienide anion; cyclopentadienide; cyclopenta-2,4-dien-1-ide
1574409 C5H6 3-Penten-1-yne, (Z)- InChI=1S/C5H6/c1-3-5-4-2/h1,4-5H,2H3/b5-4- XAJOPMVSQIBJCW-PLNGDYQASA-N C#C/C=C\C   (Z)-CH3CH=CHC#CH; 3-Penten-1-yne, (Z)-; 3-Pentene-1-yne, (Z)-; cis-2-Penten-4-yne; cis-3-Penten-1-yne; cis-Penten-1-yne; Pent-1-yn-3-ene, (Z)-; Z-3-Penten-1-yne; (Z)-pent-3-en-1-yne
2004695 C5H6 3-Penten-1-yne, (E)- InChI=1S/C5H6/c1-3-5-4-2/h1,4-5H,2H3/b5-4+ XAJOPMVSQIBJCW-SNAWJCMRSA-N C#C/C=C/C   (E)-3-Penten-1-yne; (E)-CH3CH=CHC#CH; 3-Penten-1-yne, (E)-; 3-Pentene-1-yne, (E)-; Pent-1-yn-3-ene, (E)-; trans-2-Penten-4-Yne; trans-3-Penten-1-Yne; (E)-pent-3-en-1-yne
5164352 C5H6 Bicyclo[2.1.0]pent-2-ene InChI=1S/C5H6/c1-2-5-3-4(1)5/h1-2,4-5H,3H2 CGKPQMCLTLUAOW-UHFFFAOYSA-N [C@@H]12C=C[C@@H]1C2   Bicyclo[2.1.0]pent-2-ene
6746947 C5H6 Cyclopropylacetylene InChI=1S/C5H6/c1-2-5-3-4-5/h1,5H,3-4H2 NPTDXPDGUHAFKC-UHFFFAOYSA-N C#CC1CC1   Cyclopropane,ethynyl-; Cyclopropylacetylene; ethynylcyclopropane
78808 C5H6 1-Buten-3-yne, 2-methyl- InChI=1S/C5H6/c1-4-5(2)3/h1H,2H2,3H3 BOFLDKIFLIFLJA-UHFFFAOYSA-N C=C(C)C#C   1-Buten-3-yne, 2-methyl-; 1-Butene-3-yne, 2-methyl-; 2-Methyl-1-buten-3-yne; 2-Methyl-1-butenyne; 2-Methylbut-1-en-3-yne; 2-Methylbutenyne; 3-Methyl-3-buten-1-yne; Isopropenylacetylene; Valylene
542927 C5H6 1,3-Cyclopentadiene InChI=1S/C5H6/c1-2-4-5-3-1/h1-4H,5H2 ZSWFCLXCOIISFI-UHFFFAOYSA-N C1=CC=CC1   1,3-Cyclopentadiene; Cyclopentadiene; Pentole; Pyropentylene; R-Pentine; cyclopenta-1,3-diene
10577658 C5H7 cyclopentenyl radical InChI=1S/C5H7/c1-2-4-5-3-1/h1-3H,4-5H2 MNLVCBKWEVXHGE-UHFFFAOYSA-N [CH]1[CH]CC[CH]1  
14362084 C5H7 1,3-pentadienyl radical InChI=1S/C5H7/c1-3-5-4-2/h3-5H,1-2H2 DVOOWDFPPNOBFV-UHFFFAOYSA-N C=C[CH]C=C   1,4-Pentadien-3-yl radical
591935 C5H8 1,4-Pentadiene InChI=1S/C5H8/c1-3-5-4-2/h3-4H,1-2,5H2 QYZLKGVUSQXAMU-UHFFFAOYSA-N C=CCC=C   1,4-Pentadiene; Penta-1,4-diene; pentadiene
591957 C5H8 1,2-Pentadiene InChI=1S/C5H8/c1-3-5-4-2/h5H,1,4H2,2H3 LVMTVPFRTKXRPH-UHFFFAOYSA-N C=C=CCC   1-Methyl-2,3-butadiene; 1,2-Pentadiene; Ethylallene; pentadiene; penta-1,2-diene
591968 C5H8 2,3-Pentadiene InChI=1S/C5H8/c1-3-5-4-2/h3-4H,1-2H3 PODAMDNJNMAKAZ-UHFFFAOYSA-N CC=C=CC   1,3-Dimethylallene; 2,3-Pentadiene; pentadiene; penta-2,3-diene
598254 C5H8 1,2-Butadiene, 3-methyl- InChI=1S/C5H8/c1-4-5(2)3/h1H2,2-3H3 PAKGDPSCXSUALC-UHFFFAOYSA-N C=C=C(C)C   1,1-Dimethylallene; 1,1-Dimethylallylene; 1,2-Butadiene, 3-methyl-; 2-Methyl-2,3-butadiene; 3,3-Dimethylallene; 3-Methyl-1,2-butadiene; 3-methylbuta-1,2-diene
693867 C5H8 Ethenylcyclopropane InChI=1S/C5H8/c1-2-5-3-4-5/h2,5H,1,3-4H2 YIWFBNMYFYINAD-UHFFFAOYSA-N C=CC1CC1   Cyclopropane,ethenyl-; Cyclopropylethylene; Ethenylcyclopropane; Vinylcyclopropane
627190 C5H8 1-pentyne InChI=1S/C5H8/c1-3-5-4-2/h1H,4-5H2,2H3 IBXNCJKFFQIKKY-UHFFFAOYSA-N C#CCCC   Acetylene, propyl-; Propylacetylene; pent-1-yne
142290 C5H8 Cyclopentene InChI=1S/C5H8/c1-2-4-5-3-1/h1-2H,3-5H2 LPIQUOYDBNQMRZ-UHFFFAOYSA-N C1=CCCC1   Cyclopentene
78795 C5H8 1,3-Butadiene, 2-methyl- InChI=1S/C5H8/c1-4-5(2)3/h4H,1-2H2,3H3 RRHGJUQNOFWUDK-UHFFFAOYSA-N C=C(C)C=C   1,3-Butadiene, 2-methyl-; β-Methylbivinyl; 2-Methyl-1,3-butadiene; 2-Methylbuta-1,3-diene; 2-Methylbutadiene; Isopentadiene; Isoprene; Isoprene, inhibited; UN 1218; beta-Methylbivinyl
2004708 C5H8 1,3-Pentadiene, (E)- InChI=1S/C5H8/c1-3-5-4-2/h3-5H,1H2,2H3/b5-4+ PMJHHCWVYXUKFD-SNAWJCMRSA-N C=C/C=C/C   1,3-Pentadiene, (E)-; 1,trans-3-Pentadiene; (E)-1,3-Pentadiene; (E)-CH2=CHCH=CHCH3; trans-1,3-Pentadiene; trans-1-Methylbutadiene; trans-Piperylene; pentadiene; 1,3-pentadiene; (E)-penta-1,3-diene
1574410 C5H8 1,3-Pentadiene, (Z)- InChI=1S/C5H8/c1-3-5-4-2/h3-5H,1H2,2H3/b5-4- PMJHHCWVYXUKFD-PLNGDYQASA-N C=C/C=C\C   1,3-Pentadiene, (Z)-; 1,cis-3-Pentadiene; (Z)-1,3-Pentadiene; (Z)-CH2=CHCH=CHCH3; cis-1,3-Pentadiene; cis-1-Methylbutadiene; cis-Piperylene; pentadiene; 1,3-pentadiene
1120565 C5H8 Cyclobutane, methylene- InChI=1S/C5H8/c1-5-3-2-4-5/h1-4H2 QIRVGKYPAOQVNP-UHFFFAOYSA-N C=C1CCC1   Cyclobutane, methylene-; Methylenecyclobutane
1630940 C5H10 Cyclopropane, 1,1-dimethyl- InChI=1S/C5H10/c1-5(2)3-4-5/h3-4H2,1-2H3 PBIJFSCPEFQXBB-UHFFFAOYSA-N CC1(C)CC1   1,1-Dimethylcyclopropane; Cyclopropane, 1,1-dimethyl-; Gem-Dimethylcyclopropane
109671 CH2CHCH2CH2CH3 1-pentene InChI=1S/C5H10/c1-3-5-4-2/h3H,1,4-5H2,2H3 YWAKXRMUMFPDSH-UHFFFAOYSA-N C=CCCC   pentene; α-n-Amylene; Propylethylene; Pent-1-ene
109671 CH2CHCH2CH2CH3 1-pentene InChI=1S/C5H10/c1-3-5-4-2/h3H,1,4-5H2,2H3 YWAKXRMUMFPDSH-UHFFFAOYSA-N C=CCCC   pentene; α-n-Amylene; Propylethylene; Pent-1-ene
287923 C5H10 Cyclopentane InChI=1S/C5H10/c1-2-4-5-3-1/h1-5H2 RGSFGYAAUTVSQA-UHFFFAOYSA-N C1CCCC1   Cyclopentane; Pentamethylene; UN 1146
627203 C5H10 2-Pentene, (Z)- InChI=1S/C5H10/c1-3-5-4-2/h3,5H,4H2,1-2H3/b5-3- QMMOXUPEWRXHJS-HYXAFXHYSA-N C/C=C\CC   2-(Z)-C5H10; (Z)-2-Pentene; 2-Pentene, (Z)-; cis-β-Amylene; cis-2-Pentene; cis-Pentene; (Z)-pent-2-ene
646048 C5H10 2-Pentene, (E)- InChI=1S/C5H10/c1-3-5-4-2/h3,5H,4H2,1-2H3/b5-3+ QMMOXUPEWRXHJS-HWKANZROSA-N C/C=C/CC   2-(E)-C5H10; (E)-2-Pentene; 2-Pentene, (E)-; 2-trans-Pentene; trans-β-Amylene; trans-2-Pentene; (E)-pent-2-ene
563462 C5H10 1-Butene, 2-methyl- InChI=1S/C5H10/c1-4-5(2)3/h2,4H2,1,3H3 MHNNAWXXUZQSNM-UHFFFAOYSA-N C=C(C)CC   γ-Isoamylene; 1-Butene, 2-methyl-; 1-Isoamylene; 2-Methyl-1-butene; 2-Methylbutene-1; Isopentene; UN 2459; UN 2371; gamma-Isoamylene; 2-methylbut-1-ene
513359 C5H10 2-Butene, 2-methyl- InChI=1S/C5H10/c1-4-5(2)3/h4H,1-3H3 BKOOMYPCSUNDGP-UHFFFAOYSA-N CC(C)=CC   α,η-amylene; β-Isoamylene; 1,1,2-Trimethylethylene; 2-Methyl-2-butene; 2-Methylbut-2-ene; 2-Butene, 2-methyl-; 3-Methyl-2-butene; Amylene; Ethylene, trimethyl-; Isopentene; Methyl butene; n-Amylene; UN 2371; UN 2460; Trimethylethylene; alpha,eta-amylene; beta-Isoamylene
4348350 C5H11 2-Methylbut-2-yl radical InChI=1S/C5H11/c1-4-5(2)3/h4H2,1-3H3 CGERYHYIVJQVLJ-UHFFFAOYSA-N C[C](C)CC   2-Methylbut-2-yl radical; 2-Butyl radical, 2-methyl-; 2-Methylbutan-2-yl
463821 C5H12 Propane, 2,2-dimethyl- InChI=1S/C5H12/c1-5(2,3)4/h1-4H3 CRSOQBOWXPBRES-UHFFFAOYSA-N CC(C)(C)C   2,2-Dimethylpropane; 1,1,1-Trimethylethane; Neo-C5H12; Neopentane; Propane, 2,2-dimethyl-; tert-Pentane; Tetramethylcarbon; Tetramethylmethane; UN 1265; UN 2044
109660 C5H12 Pentane InChI=1S/C5H12/c1-3-5-4-2/h3-5H2,1-2H3 OFBQJSOFQDEBGM-UHFFFAOYSA-N CCCCC   n-C5H12; n-Pentane; Pentan; Pentane; Pentanen; Pentani; Skellysolve A; UN 1265
78784 C5H12 Butane, 2-methyl- InChI=1S/C5H12/c1-4-5(2)3/h5H,4H2,1-3H3 QWTDNUCVQCZILF-UHFFFAOYSA-N CC(C)CC   1,1,2-Trimethylethane; 2-Methylbutane; Butane, 2-methyl-; Ethyldimethylmethane; Isoamylhydride; iso-C5H12; iso-Pentane; isopentane
157404 C5H8 Spiropentane InChI=1S/C5H8/c1-2-5(1)3-4-5/h1-4H2 OGNAOIGAPPSUMG-UHFFFAOYSA-N C1CC12CC2   Spiro[2.2]pentane; Spiropentane
185944 C5H8 Bicyclo[2.1.0]pentane InChI=1S/C5H8/c1-2-5-3-4(1)5/h4-5H,1-3H2 MHLPKAGDPWUOOT-UHFFFAOYSA-N [C@@H]12CC[C@@H]1C2   Bicyclo[2.1.0]pentane
288948 CH2N4 1H-Tetrazole InChI=1S/CH2N4/c1-2-4-5-3-1/h1H,(H,2,3,4,5) KJUGUADJHNHALS-UHFFFAOYSA-N N1N=NN=C1   1H-Tetrazole; 2H-Tetrazole; Tetraazacyclopentadiene; Tetrazole
109773 C3H2N2 Malononitrile InChI=1S/C3H2N2/c4-2-1-3-5/h1H2 CUONGYYJJVDODC-UHFFFAOYSA-N N#CCC#N   Cyanoacetonitrile; Dicyanomethane; Dwumetylosulfotlenku; Malonic acid dinitrile; Malonic dinitrile; Malonitrile; Malonodinitrile; Malononitrile; Methane, dicyano-; Methylene cyanide; Methylenedinitrile; Nitril kyseliny malonove; Propanedinitrile; Propanedinitrite; Rcra waste number U149; UN 2647; USAF KF-19; USAF a-4600
288880 C2H3N3 1H-1,2,4-Triazole InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5) NSPMIYGKQJPBQR-UHFFFAOYSA-N N1=CN=CN1   1,2,4-Triazole; 1H-1,2,4-Triazole; s-Triazole; triazole
36954037 C3H3N2- imidizolyl anion InChI=1S/C3H3N2/c1-2-5-3-4-1/h1-3H/q-1 JBFYUZGYRGXSFL-UHFFFAOYSA-N [CH-]1N=CC=N1  
36954037 C3H3N2 imidazolyl radical InChI=1S/C3H3N2/c1-2-5-3-4-1/h1-3H AODALHUPEBREOC-UHFFFAOYSA-N [CH]1N=CC=N1  
23303095 C4H4N- pyrrolide anion InChI=1S/C4H4N/c1-2-4-5-3-1/h1-4H/q-1 KFFMWJLUQMFKOH-UHFFFAOYSA-N [N-]1C=CC=C1  
23303095 C4H4N pyrrolide radical InChI=1S/C4H4N/c1-2-4-5-3-1/h1-4H RRIPJBIUAZFPTE-UHFFFAOYSA-N [N]1C=CC=C1  
288131 C3H4N2 1H-Pyrazole InChI=1S/C3H4N2/c1-2-4-5-3-1/h1-3H,(H,4,5) WTKZEGDFNFYCGP-UHFFFAOYSA-N N1N=CC=C1   1,2-Diazole; 1H-Pyrazole; Pyrazole
288324 C3H4N2 1H-Imidazole InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5) RAXXELZNTBOGNW-UHFFFAOYSA-N C1=NC=CN1   1,3-Diaza-2,4-cyclopentadiene; 1,3-Diazole; 1H-Imidazole; Formamidine, N,N'-vinylene-; Glyoxalin; Glyoxaline; IMD; Imidazol; Imidazole; Iminazole; Imutex; Methanimidamide, N,N'-1,2-ethenediyl-; Miazole; Pyrro(b)monazole; USAF ek-4733
9000162 C3H4N2 4H-Imidazole InChI=1S/C3H4N2/c1-2-5-3-4-1/h1,3H,2H2 LGRQUXHYJBFGTM-UHFFFAOYSA-N C1=NCC=N1  
9000173 C3H4N2 2H-Imidazole InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-2H,3H2 ACVSHQGHCWUJFU-UHFFFAOYSA-N C1N=CC=N1  
9000366 C4H5N 3H-pyrrole InChI=1S/C4H5N/c1-2-4-5-3-1/h1,3-4H,2H2 VXIKDBJPBRMXBP-UHFFFAOYSA-N N1=CCC=C1  
5500210 C4H5N Cyclopropanecarbonitrile InChI=1S/C4H5N/c5-3-4-1-2-4/h4H,1-2H2 AUQDITHEDVOTCU-UHFFFAOYSA-N N#CC1CC1   Cyanocyclopropane; Cyclopropanecarbonitrile; Cyclopropanecarboxylic acid nitrile; Cyclopropanenitrile; Cyclopropyl cyanide; Cyclopropylnitrile
1190767 C4H5N (Z)-2-Butenenitrile InChI=1S/C4H5N/c1-2-3-4-5/h2-3H,1H3/b3-2- NKKMVIVFRUYPLQ-IHWYPQMZSA-N C/C=C\C#N   (Z)-2-Butenenitrile; (Z)-CH3CH=CHCN; (Z)-but-2-enenitrile
627269 C4H5N (E)-2-Butenenitrile InChI=1S/C4H5N/c1-2-3-4-5/h2-3H,1H3/b3-2+ NKKMVIVFRUYPLQ-NSCUHMNNSA-N C/C=C/C#N   2-Butenenitrile, (E)-; (E)-2-Butenenitrile; (E)-CH3CH=CHCN; (E)-but-2-enenitrile
109977 C4H5N Pyrrole InChI=1S/C4H5N/c1-2-4-5-3-1/h1-5H KAESVJOAVNADME-UHFFFAOYSA-N N1C=CC=C1   1-Aza-2,4-cyclopentadiene; 1H-Pyrrole; Azole; Divinyleneimine; Divinylenimine; Imidole; Monopyrrole; Parzate; Pyrrol; Pyrrole
9000377 C4H5N 2H-pyrrole InChI=1S/C4H5N/c1-2-4-5-3-1/h1-3H,4H2 JZIBVTUXIVIFGC-UHFFFAOYSA-N N1=CC=CC1  
151188 C3H6N2 3-Aminopropionitrile InChI=1S/C3H6N2/c4-2-1-3-5/h1-2,4H2 AGSPXMVUFBBBMO-UHFFFAOYSA-N N#CCCN   β-Alaminenitrile; β-Alaninenitrile; β-Aminoethyl cyanide; β-Aminopropionitrile; β-Cyanoethylamine; 2-Cyanoethylamine; 3-Aminopropanenitrile; 3-Aminopropionitrile; Aminopropionitrile; BAPN; Propanenitrile, 3-amino-; Propionitrile, 3-amino-; beta-Alaminenitrile; beta-Alaninenitrile; beta-Aminoethyl cyanide; beta-Aminopropionitrile; beta-Cyanoethylamine; 3-aminopropanenitrile
109740 CH3CH2CH2CN Butanenitrile InChI=1S/C4H7N/c1-2-3-4-5/h2-3H2,1H3 KVNRLNFWIYMESJ-UHFFFAOYSA-N CCCC#N   1-Cyanopropane; Butanenitrile; Butyric acid nitrile; Butyronitrile; Butyrylonitrile; n-Butanenitrile; n-Butanitrile; n-Butyronitrile; n-C3H7CN; Propyl cyanide; Propylkyanid; UN 2411
78820 CH3CH(CH3)CN Propanenitrile, 2-methyl- InChI=1S/C4H7N/c1-4(2)3-5/h4H,1-2H3 LRDFRRGEGBBSRN-UHFFFAOYSA-N CC(C)C#N   α-Methylpropanenitrile; 1-Cyano-1-methylethane; 2-Cyanopropane; 2-Methylpropanenitrile; 2-Methylpropionitrile; Dimethylacetonitrile; Isobutyronitrile; iso-C3H7CN; Isopropyl cyanide; Isopropylkyanid; Isopropylnitrile; Propanenitrile, 2-methyl-; UN 2284; alpha-Methylpropanenitrile
123751 C4H9N Pyrrolidine InChI=1S/C4H9N/c1-2-4-5-3-1/h5H,1-4H2 RWRDLPDLKQPQOW-UHFFFAOYSA-N N1CCCC1   Azacyclopentane; Azolidine; Butylenimine; Perhydropyrrole; Prolamine; Pyrrole, tetrahydro-; Pyrrolidene; Pyrrolidine; Tetrahydropyrrole; Tetramethylenimine; UN 1922
2516349 C4H9N Cyclobutylamine InChI=1S/C4H9N/c5-4-2-1-3-4/h4H,1-3,5H2 KZZKOVLJUKWSKX-UHFFFAOYSA-N NC1CCC1   Aminocyclobutane; Cyclobutanamine; Cyclobutylamine
78900 C3H10N2 1,2-Diaminopropane InChI=1S/C3H10N2/c1-3(5)2-4/h3H,2,4-5H2,1H3 AOHJOMMDDJHIJH-UHFFFAOYSA-N C[C@@H](N)CN   1,2-Diaminopropane; 1,2-Propanediamine; 1,2-Propylenediamine; Propylenediamine; UN 2258; propane-1,2-diamine
78819 C(NH2)H2C(CH3)HCH3 1-Propanamine, 2-methyl- InChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3 KDSNLYIMUZNERS-UHFFFAOYSA-N CC(C)CN   1-Propanamine, 2-methyl-; 1-Amino-2-methylpropane; 2-Methyl-1-Aminopropane; 2-Methyl-1-propanamine; 2-Methylpropylamine; 3-Methyl-2-propylamine; IBA; i-Butylamine; Isobutylamine; iso-C4H9NH2; Monoisobutylamine; UN 1214; Valamine; 2-methylpropan-1-amine
75649 C(CH3)3NH2 2-Propanamine, 2-methyl- InChI=1S/C4H11N/c1-4(2,3)5/h5H2,1-3H3 YBRBMKDOPFTVDT-UHFFFAOYSA-N CC(N)(C)C   1,1-Dimethylethylamine; 2-Methyl-2-aminopropane; 2-Methyl-2-propanamine; 2-Methyl-2-propylamine; 2-Amino-2-Methylpropane; 2-Aminoisobutane; 2-Propanamine, 2-methyl-; Butylamine, tert; Butylamine, tertiary; t-Butylamine; tert-Butylamine; tert-C4H9NH2; Trimethylaminomethane; 2-methylpropan-2-amine
109739 C(NH2)H2CH2CH2CH3 1-Butanamine InChI=1S/C4H11N/c1-2-3-4-5/h2-5H2,1H3 HQABUPZFAYXKJW-UHFFFAOYSA-N CCCCN   1-Amino-butaan; 1-Aminobutan; 1-Aminobutane; 1-Butanamine; 1-Butanaminen-butilamina; 1-Butylamine; Butylamine; Butylamine, n; Monobutilamina; Monobutylamine; Mono-n-butylamine; n-Butilamina; N-Butylamin; n-Butylamine; n-C4H9NH2; Norvalamine; UN 1125; butan-1-amine
13952846 CH3C(NH2)HCH2CH3 2-Butanamine InChI=1S/C4H11N/c1-3-4(2)5/h4H,3,5H2,1-2H3 BHRZNVHARXXAHW-UHFFFAOYSA-N C[C@H](N)CC   1-Methylpropanamine; 1-Methylpropylamine; 2-AB; 2-Aminobutane; 2-Aminobutane base; 2-Butanamine; 2-Butylamine; (Rs)-2-aminobutane; (Rs)-sec-butylamine; Butafume; Deccotane; Frucote; Propylamine, 1-Methyl-; sec-Butanamine; sec-Butylamine; sec-C4H9NH2; Secondary butylamine; Tutane; butan-2-amine
51923 NC4H12+ tetramethyl ammonium cation InChI=1S/C4H12N/c1-5(2,3)4/h1-4H3/q+1 QEMXHQIAXOOASZ-UHFFFAOYSA-N C[N+](C)(C)C  
10544737 N2O3 Dinitrogen trioxide InChI=1S/N2O3/c3-1-2(4)5 LZDSILRDTDCIQT-UHFFFAOYSA-N O=N(N=O)=O   Dinitrogen trioxide; Nitrogen oxide; Nitrogen oxide (N2O3); Nitrogen trioxide
122413358 ONONO Nitrosyl nitrite InChI=1S/N2O3/c3-1-5-2-4 SEOYNUHKXVGWFU-UHFFFAOYSA-N O=NON=O  
744998978 BeCO3 Beryllium Carbonate InChI=1S/CH2O3.Be/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2 ZBUQRSWEONVBES-UHFFFAOYSA-L O=C1O[Be]O1  
504643 C3O2 Carbon suboxide InChI=1S/C3O2/c4-2-1-3-5 GNEVIACKFGQMHB-UHFFFAOYSA-N O=C=C=C=O   1,2-Propadiene-1,3-dione; Carbon oxide (C3O2); Carbon suboxide; propa-1,2-diene-1,3-dione
504643 C3O2 Carbon suboxide InChI=1S/C3O2/c4-2-1-3-5 GNEVIACKFGQMHB-UHFFFAOYSA-N O=C=C=C=O   1,2-Propadiene-1,3-dione; Carbon oxide (C3O2); Carbon suboxide; propa-1,2-diene-1,3-dione
504643 C3O2+ Carbon suboxide cation InChI=1S/C3O2/c4-2-1-3-5/q+1 HLDIYZBNFHMYOY-UHFFFAOYSA-N O=C=[C+]=C=O  
26404660 HOONO2 peroxy nitric acid InChI=1S/HNO4/c2-1(3)5-4/h4H UUZZMWZGAZGXSF-UHFFFAOYSA-N OO[N+]([O-])=O  
471250 C3H2O2 Propiolic acid InChI=1S/C3H2O2/c1-2-3(4)5/h1H,(H,4,5) UORVCLMRJXCDCP-UHFFFAOYSA-N C#CC(O)=O   Acetylenecarboxylic acid; Propynoic acid; 2-Propynoic acid; Carboxyacetylene; Propargylic acid; Propinoic acid
298124 CHOCOOH oxo acetic acid InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5) HHLFWLYXYJOTON-UHFFFAOYSA-N O=CC(O)=O   Glyoxylic acid; a-Ketoacetic acid; Formic acid, formyl-; Formylformic acid; Glyoxalic acid; Oxalaldehydic acid; Oxoacetic acid; Oxoethanoic acid; Acetic acid, oxo-; 2-oxoacetic acid
288426 C3H3NO Oxazole InChI=1S/C3H3NO/c1-2-5-3-4-1/h1-3H ZCQWOFVYLHDMMC-UHFFFAOYSA-N O1C=NC=C1   1,3-Oxazole; Oxazole
288142 C3H3NO Isoxazole InChI=1S/C3H3NO/c1-2-4-5-3-1/h1-3H CTAPFRYPJLPFDF-UHFFFAOYSA-N O1N=CC=C1   1-Oxa-2-azacyclopentadiene; Isooxazole; Isoxazole
598583 CH3NO3 Methyl nitrate InChI=1S/CH3NO3/c1-5-2(3)4/h1H3 LRMHVVPPGGOAJQ-UHFFFAOYSA-N O=[N+]([O-])OC   Methyl nitrate; Methylester kyseliny dusicne; Nitric acid, methyl ester
36709101 CH3C(O)OO acetyl peroxy radical InChI=1S/C2H3O3/c1-2(3)5-4/h1H3 ZBQKPDHUDKSCRS-UHFFFAOYSA-N CC(O[O])=O  
9000400 HOCHCCHOH allenediol InChI=1S/C3H4O2/c4-2-1-3-5/h2-5H/t1-/m0/s1 AGRXSXQEULWPJL-SFOWXEAESA-N OC=C=CO  
542789 C3H4O2 propanedial InChI=1S/C3H4O2/c4-2-1-3-5/h2-3H,1H2 WSMYVTOQOOLQHP-UHFFFAOYSA-N O=CCC=O  
289145 C2H4O3 trioxolane124 InChI=1S/C2H4O3/c1-3-2-5-4-1/h1-2H2 RZYIPLSVRHWROD-UHFFFAOYSA-N O1OCOC1   trioxolane; 1,2,4-Trioxolane
57578 C3H4O2 β–Propiolactone InChI=1S/C3H4O2/c4-3-1-2-5-3/h1-2H2 VEZXCJBBBCKRPI-UHFFFAOYSA-N O=C1CCO1   1,3-Propiolactone; β-lactone hydracrylic acid; β-Propanoic acid lactone; β-Propiolactone; β-Propiolakton; β-Propionolactone; β-Propriolactone; β-Proprolactone; 2-Oxacyclobutanone; 2-Oxetanone; 2-Oxooxetane; 3-Hydroxypropionic acid, lactone; 3-Propanolide; 3-Propiolactone; Betaprone; Bpl; Hydracrylic acid β-lactone; Propanoic acid, 3-hydroxy-, β-lactone; Propanolide; Propiolactone; Propiolactone β-; Propionic acid, 3-hydroxy-, β-lactone; beta-lactone hydracrylic acid; beta-Propanoic acid lactone; beta-Propiolactone; beta-Propiolakton; beta-Propionolactone; beta-Propriolactone; beta-Proprolactone; oxetan-2-one
110009 C4H4O Furan InChI=1S/C4H4O/c1-2-4-5-3-1/h1-4H YLQBMQCUIZJEEH-UHFFFAOYSA-N O1C=CC=C1   Divinylene oxide; Furan; Furane; Furfuran; Furfurane; NCI-C56202; Oxacyclopentadiene; Oxole; Rcra waste number U124; Tetrole; UN 2389
110009 C4H4O+ Furan cation InChI=1S/C4H5O/c1-2-4-5-3-1/h1,3-4H,2H2/q+1 ZHAFRCMLNKUIDV-UHFFFAOYSA-N [CH+]1[CH]C=CO1  
110009 C4H4O+ Furan cation InChI=1/C4H5O/c1-2-4-5-3-1/h1,3-4H,2H2/q+1 ZHAFRCMLNKUIDV-UHFFFAOYNA-N [CH+]1[CH]C=CO1  
78988 C3H4O2 Methyl glyoxal InChI=1S/C3H4O2/c1-3(5)2-4/h2H,1H3 AIJULSRZWUXGPQ-UHFFFAOYSA-N CC(C=O)=O   Pyruvaldehyde; Propanal, 2-oxo-; a-Ketopropionaldehyde; Acetylformaldehyde; Acetylformyl; Pyroracemic aldehyde; Pyruvic aldehyde; 2-Ketopropionaldehyde; 2-Oxopropanal; 1,2-Propanedione; Glyoxal, methyl; Propanedione; Propanolone; Propionaldehyde, 2-keto; Propionaldehyde, 2-oxo-; 2-Oxopropionaldehyde
79107 C3H4O2 2-Propenoic acid InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5) NIXOWILDQLNWCW-UHFFFAOYSA-N C=CC(O)=O   2-Propenoic acid; Acroleic acid; Acrylic acid; Acrylic acid, glacial; Acrylic acid, inhibited; Ethylenecarboxylic acid; Glacial acrylic acid; Kyselina akrylova; Propene acid; Propenoic acid; Rcra waste number U008; UN 2218; Vinylformic acid
79141 HOCH2COOH Hydroxyacetic acid InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5) AEMRFAOFKBGASW-UHFFFAOYSA-N OC(CO)=O   Acetic acid, hydroxy-; Glycolic acid; a-Hydroxyacetic acid; Glycollic acid; Hydroxyethanoic acid; 2-Hydroxyacetic acid
79141 HOCH2COOH Hydroxyacetic acid InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5) AEMRFAOFKBGASW-UHFFFAOYSA-N OC(CO)=O   Acetic acid, hydroxy-; Glycolic acid; a-Hydroxyacetic acid; Glycollic acid; Hydroxyethanoic acid; 2-Hydroxyacetic acid
6669369 C2H4O3 1,2,3-trioxolane InChI=1S/C2H4O3/c1-2-4-5-3-1/h1-2H2 MAAKQSASDHJHIR-UHFFFAOYSA-N O1OCCO1   molozonide
9000128 C3H4O2 propenalol InChI=1S/C3H4O2/c4-2-1-3-5/h1-4H/b2-1- GMSHJLUJOABYOM-UPHRSURJSA-N O\C=C/C=O  
9000128 C3H4O2 propenalol InChI=1S/C3H4O2/c4-2-1-3-5/h1-4H GMSHJLUJOABYOM-UHFFFAOYSA-N OC=CC=O  
1738369 CH3OCH2CN Methoxyacetonitrile InChI=1S/C3H5NO/c1-5-3-2-4/h3H2,1H3 QKPVEISEHYYHRH-UHFFFAOYSA-N N#CCOC   Acetonitrile, methoxy-; Methoxyacetonitrile; NCCH2OCH3; 2-methoxyacetonitrile
1738369 CH3OCH2CN Methoxyacetonitrile InChI=1S/C3H5NO/c1-5-3-2-4/h3H2,1H3 QKPVEISEHYYHRH-UHFFFAOYSA-N N#CCOC   Acetonitrile, methoxy-; Methoxyacetonitrile; NCCH2OCH3; 2-methoxyacetonitrile
79061 CH2CHCONH2 Acrylamide InChI=1S/C3H5NO/c1-2-3(4)5/h2H,1H2,(H2,4,5) HRPVXLWXLXDGHG-UHFFFAOYSA-N C=CC(N)=O   2-Propenamide; Acrylamide; Acrylic amide; Akrylamid; Amid kyseliny akrylove; Ethylenecarboxamide; Propenamide; Rcra waste number U007; Vinyl amide; UN 2074
56406 H2NCH2COOH Glycine InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5) DHMQDGOQFOQNFH-UHFFFAOYSA-N NCC(O)=O   Gly; Glicoamin; Glycosthene; Amitone; glycine; Aminoacetic acid; Aminoethanoic acid; Glycocoll; Glycolixir; 2-aminoacetic acid
79094 CH3CH2COOH Propanoic Acid InChI=1S/C3H6O2/c1-2-3(4)5/h2H2,1H3,(H,4,5) XBDQKXXYIPTUBI-UHFFFAOYSA-N CCC(O)=O   Propionic acid; Carboxyethane; Ethanecarboxylic acid; Metacetonic acid; Methylacetic acid; n-Propionic acid
79209 CH3COOCH3 methyl acetate InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3 KXKVLQRXCPHEJC-UHFFFAOYSA-N CC(OC)=O   Acetate de methyle; Acetic acid, methyl ester; Devoton; Ethyl ester of monoacetic acid; Methyl acetate; Methyl acetic ester; Methyl ester of acetic acid; Methyl ethanoate; Methylacetaat; Methylacetat; Methyle (acetate de); Methylester kiseliny octove; Metile; Metile (acetato di); Octan metylu; Tereton; UN 1231
109933 CH2CHOCHCH2 Vinyl ether InChI=1S/C4H6O/c1-3-5-4-2/h3-4H,1-2H2 QYKIQEUNHZKYBP-UHFFFAOYSA-N C=COC=C   1,1'-Oxybisethene; Divinyl ether; Divinyl ether, inhibited; Divinyl oxide; Ethene, 1,1'-oxybis-; Ethenyloxyethene; Ether, divinyl; UN 1167; Vinyl Ether; Vinether; Vinidyl; Vinydan; Vinethen; Vinethene; Vinesthene; Vinesthesin; ether; (vinyloxy)ethene
109933 CH2CHOCHCH2 Vinyl ether InChI=1S/C4H6O/c1-3-5-4-2/h3-4H,1-2H2 QYKIQEUNHZKYBP-UHFFFAOYSA-N C=COC=C   1,1'-Oxybisethene; Divinyl ether; Divinyl ether, inhibited; Divinyl oxide; Ethene, 1,1'-oxybis-; Ethenyloxyethene; Ether, divinyl; UN 1167; Vinyl Ether; Vinether; Vinidyl; Vinydan; Vinethen; Vinethene; Vinesthene; Vinesthesin; ether; (vinyloxy)ethene
109944 HCOOC2H5 Ethyl formate InChI=1S/C3H6O2/c1-2-5-3-4/h3H,2H2,1H3 WBJINCZRORDGAQ-UHFFFAOYSA-N O=COCC   Aethylformiat; Areginal; Ethyl ester of formic acid; Ethyl formate; Ethyl methanoate; Ethyle; Ethyle(formiate d'); Ethylester kyseliny mravenci; Ethylformiaat; Ethylformic ester; Etile; Etile(formiato di); Formic acid, ethyl ester; Formic ether; Mrowczan etylu; UN 1190
598505 C2H6N2O Urea, methyl- InChI=1S/C2H6N2O/c1-4-2(3)5/h1H3,(H3,3,4,5) XGEGHDBEHXKFPX-UHFFFAOYSA-N O=C(N)NC   1-Methylurea; Methylmocovina; Methylurea; Monomethylurea; N-Methylurea; Urea, methyl-
646060 C3H6O2 1,3-Dioxolane InChI=1S/C3H6O2/c1-2-5-3-4-1/h1-3H2 WNXJIVFYUVYPPR-UHFFFAOYSA-N O1COCC1   1,3-Dioxacyclopentane; 1,3-Dioxolan; 1,3-Dioxolane; 1,3-Dioxole, dihydro-; Dioxolan; Dioxolane; Ethylene glycol, formal; Formal glycol; Glycolformal
646060 C3H6O2 1,3-Dioxolane InChI=1S/C3H6O2/c1-2-5-3-4-1/h1-3H2 WNXJIVFYUVYPPR-UHFFFAOYSA-N O1COCC1   1,3-Dioxacyclopentane; 1,3-Dioxolan; 1,3-Dioxolane; 1,3-Dioxole, dihydro-; Dioxolan; Dioxolane; Ethylene glycol, formal; Formal glycol; Glycolformal
1708298 C4H6O Furan, 2,5-dihydro- InChI=1S/C4H6O/c1-2-4-5-3-1/h1-2H,3-4H2 ARGCQEVBJHPOGB-UHFFFAOYSA-N O1CC=CC1   1-Oxa-3-cyclopentene; 3-Oxolene; 2,5-dihydrofuran
1191953 C4H6O Cyclobutanone InChI=1S/C4H6O/c5-4-2-1-3-4/h1-3H2 SHQSVMDWKBRBGB-UHFFFAOYSA-N O=C1CCC1   Cyclobutanone
1191997 C4H6O Furan, 2,3-dihydro- InChI=1S/C4H6O/c1-2-4-5-3-1/h1,3H,2,4H2 JKTCBAGSMQIFNL-UHFFFAOYSA-N O1CCC=C1   2,3-Dihydrofuran; 4,5-Dihydrofuran; Furan, 2,3-dihydro-
4170303 CHOCHCHCH3 2-Butenal InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3 MLUCVPSAIODCQM-UHFFFAOYSA-N C/C=C/C=O   β-Methyl acrolein; 2-Butenal; Crotonal; Crotonaldehyde; Crotonaldehyde, inhibited; Crotonic aldehyde; Crotylaldehyde; Krotonaldehyd; Propylene aldehyde; Rcra waste number U053; UN 1143; beta-Methyl acrolein; (E)-but-2-enal
15798648 C4H6O cis-2-butenal InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2- MLUCVPSAIODCQM-IHWYPQMZSA-N C/C=C\C=O  
79050 C3H7NO Propanamide InChI=1S/C3H7NO/c1-2-3(4)5/h2H2,1H3,(H2,4,5) QLNJFJADRCOGBJ-UHFFFAOYSA-N CCC(N)=O   Amid kyseliny propionove; Propanamide; Propanimidic acid; Propionamide; Propionic acid amide; Propionic amide; Propionimidic acid; propionamide
68122 C3H7NO dimethylformamide InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3 ZMXDDKWLCZADIW-UHFFFAOYSA-N CN(C)C=O   Formamide, N,N-dimethyl-; DMFA; N-Formyldimethylamine; N,N-Dimethylformamide; Formyldimethylamine; Dimethylforamide; NSC-5356; U-4224; NCI-C60913; UN 2265; DMF
68122 C3H7NO dimethylformamide InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3 ZMXDDKWLCZADIW-UHFFFAOYSA-N CN(C)C=O   Formamide, N,N-dimethyl-; DMFA; N-Formyldimethylamine; N,N-Dimethylformamide; Formyldimethylamine; Dimethylforamide; NSC-5356; U-4224; NCI-C60913; UN 2265; DMF
57556 C3H8O2 Propylene glycol InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3 DNIAPMSPPWPWGF-UHFFFAOYSA-N CC(O)CO   α-Propylene glycol; 1,2-Dihydroxypropane; 1,2-Propanediol; 1,2-Propylene Glycol; 1,2-Propylenglykol; 2-Hydroxypropanol; 2,3-Propanediol; Dowfrost; Isopropylene glycol; Methyl glycol; Methylethyl glycol; Methylethylene glycol; Monopropylene glycol; PG 12; Propane-1,2-diol; Propylene Glycol; Propylene glycol usp; Sentry Propylene Glycol; Sirlene; Solar winter ban; Solargard P; Trimethyl glycol; Ucar 35; alpha-Propylene glycol
78933 CH3COCH2CH3 2-Butanone InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3 ZWEHNKRNPOVVGH-UHFFFAOYSA-N CC(CC)=O   2-Butanone; 3-Butanone; Acetone, methyl-; Aethylmethylketon; Butan-2-one; Butanone; Butanone 2; Ethyl methyl cetone; Ethyl methyl ketone; Ethylmethylketon; Ketone, ethyl methyl; Ketone, methyl ethyl; Meetco; MEK; Methyl acetone; Methyl ethyl ketone; Metiletilchetone; Metyloetyloketon; Rcra waste number U159; UN 1232; UN 1193
78933 CH3COCH2CH3 2-Butanone InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3 ZWEHNKRNPOVVGH-UHFFFAOYSA-N CC(CC)=O   2-Butanone; 3-Butanone; Acetone, methyl-; Aethylmethylketon; Butan-2-one; Butanone; Butanone 2; Ethyl methyl cetone; Ethyl methyl ketone; Ethylmethylketon; Ketone, ethyl methyl; Ketone, methyl ethyl; Meetco; MEK; Methyl acetone; Methyl ethyl ketone; Metiletilchetone; Metyloetyloketon; Rcra waste number U159; UN 1232; UN 1193
78842 CHOCH(CH3)CH3 Propanal, 2-methyl- InChI=1S/C4H8O/c1-4(2)3-5/h3-4H,1-2H3 AMIMRNSIRUDHCM-UHFFFAOYSA-N CC(C)C=O   α-Methylpropionaldehyde; 2-Methyl-1-propanal; 2-Methylpropanal; 2-Methylpropionaldehyde; Isobutaldehyde; Isobutanal; Isobutylaldehyde; Isobutyral; Isobutyraldehyd; Isobutyraldehyde; Isobutyric aldehyde; Isobutyryl aldehyde; iso-C3H7CHO; Isopropylaldehyde; Isopropylformaldehyde; Methyl propanal; NCI-C60968; Propanal, 2-methyl-; Propionaldehyde, 2-methyl-; UN 2045; Valine aldehyde; alpha-Methylpropionaldehyde
109999 C4H8O Furan, tetrahydro- InChI=1S/C4H8O/c1-2-4-5-3-1/h1-4H2 WYURNTSHIVDZCO-UHFFFAOYSA-N O1CCCC1   Butane α,δ-oxide; Butane, 1,4-epoxy-; Butylene Oxide; Cyclotetramethylene oxide; Diethylene oxide; Furan, tetrahydro-; Furanidine; Hydrofuran; NCI-C60560; Oxacyclopentane; Oxolane; Rcra waste number U213; Tetrahydrofuraan; Tetrahydrofuran; Tetrahydrofuranne; Tetraidrofurano; Tetramethylene oxide; THF; UN 2056
109875 C3H8O2 Methane, dimethoxy- InChI=1S/C3H8O2/c1-4-3-5-2/h3H2,1-2H3 NKDDWNXOKDWJAK-UHFFFAOYSA-N COCOC   2,4-Dioxapentane; Anesthenyl; Dimethoxymethane; Dimethyl formal; Formal; Formaldehyde dimethyl; Formaldehyde dimethyl acetal; Formaldehyde methyl ketal; Methane, dimethoxy-; Methoxymethyl methyl ether; Methyl formal; Methylal; Methylene dimethyl ether; Methylene glycol dimethylether; Methylenedioxydimethane; Metylal; UN 1234; ether
109875 C3H8O2 Methane, dimethoxy- InChI=1S/C3H8O2/c1-4-3-5-2/h3H2,1-2H3 NKDDWNXOKDWJAK-UHFFFAOYSA-N COCOC   2,4-Dioxapentane; Anesthenyl; Dimethoxymethane; Dimethyl formal; Formal; Formaldehyde dimethyl; Formaldehyde dimethyl acetal; Formaldehyde methyl ketal; Methane, dimethoxy-; Methoxymethyl methyl ether; Methyl formal; Methylal; Methylene dimethyl ether; Methylene glycol dimethylether; Methylenedioxydimethane; Metylal; UN 1234; ether
109922 C2H3OC2H5 Ethene, ethoxy- InChI=1S/C4H8O/c1-3-5-4-2/h3H,1,4H2,2H3 FJKIXWOMBXYWOQ-UHFFFAOYSA-N C=COCC   1-Ethoxyethene; 1-Ethoxyethylene; Ethene, ethoxy-; Ether, ethyl vinyl; Ether, ethyl vinyl (inhibited); Ether, vinyl ethyl; Ethoxyethene; Ethoxyethylene; Ethyl ethenyl ether; Ethyl vinyl ether; Ethyloxyethene; EVE; ether; UN 1302; Vinyl ethyl ether, inhibited; Vinamar; Vinyl Ethyl ether
504632 C3H8O2 1,3-Propanediol InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2 YPFDHNVEDLHUCE-UHFFFAOYSA-N OCCCO   1,3-Dihydroxypropane; 1,3-Propanediol; 1,3-Propylene glycol; 1,3-Propylenediol; 2-(Hydroxymethyl)ethanol; β-Propylene glycol; ω-Propanediol; 2-Deoxyglycerol; NSC 65426; PG; Propane-1,3-diol; Propanediol-(1,3)-(1,3-propylene glycol); Propylene glycol; Trimethylene Glycol; beta-Propylene glycol; omega-Propanediol
504632 C3H8O2 1,3-Propanediol InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2 YPFDHNVEDLHUCE-UHFFFAOYSA-N OCCCO   1,3-Dihydroxypropane; 1,3-Propanediol; 1,3-Propylene glycol; 1,3-Propylenediol; 2-(Hydroxymethyl)ethanol; β-Propylene glycol; ω-Propanediol; 2-Deoxyglycerol; NSC 65426; PG; Propane-1,3-diol; Propanediol-(1,3)-(1,3-propylene glycol); Propylene glycol; Trimethylene Glycol; beta-Propylene glycol; omega-Propanediol
116110 CH2C(CH3)OCH3 1-Propene, 2-methoxy- InChI=1S/C4H8O/c1-4(2)5-3/h1H2,2-3H3 YOWQWFMSQCOSBA-UHFFFAOYSA-N C=C(OC)C   1-Propene, 2-methoxy-; 2-Methoxy-1-propene; 2-Methoxypropene; Ether, isopropenyl methyl; Isopropenyl methyl ether; Methyl isopropenyl ether; ether; 2-methoxyprop-1-ene
123728 CHOCH2CH2CH3 Butanal InChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3 ZTQSAGDEMFDKMZ-UHFFFAOYSA-N CCCC=O   Aldehyde butyrique; Aldeide butirrica; Butal; Butaldehyde; Butalyde; Butanal; Butanaldehyde; Butyl aldehyde; Butyral; Butyraldehyd; Butyraldehyde; Butyric aldehyde; Butyrylaldehyde; n-Butanal; n-Butyl aldehyde; n-Butyraldehyde; n-C3H7CHO; NCI-C56291; UN 1129
3031752 C3H8O2 Hydroperoxide, 1-methylethyl InChI=1S/C3H8O2/c1-3(2)5-4/h3-4H,1-2H3 SGJUFIMCHSLMRJ-UHFFFAOYSA-N CC(OO)C   Hydroperoxide, 1-methylethyl; Isopropyl hydroperoxide; 2-hydroperoxypropane
2919235 C4H8O Cyclobutanol InChI=1S/C4H8O/c5-4-2-1-3-4/h4-5H,1-3H2 KTHXBEHDVMTNOH-UHFFFAOYSA-N OC1CCC1   Cyclobutanol; Cyclobutyl hydroxide
557175 C4H10O Methyl propyl ether InChI=1S/C4H10O/c1-3-4-5-2/h3-4H2,1-2H3 VNKYTQGIUYNRMY-UHFFFAOYSA-N CCCOC   1-Methoxypropane; α-Methoxy propane; Ether, methyl propyl; Methyl n-propyl ether; Methyl propyl ether; Metopryl; n-C3H7OCH3; Neothyl; Propane, 1-methoxy-; UN 2612; ether; alpha-Methoxy propane
598538 C4H10O Propane, 2-methoxy- InChI=1S/C4H10O/c1-4(2)5-3/h4H,1-3H3 RMGHERXMTMUMMV-UHFFFAOYSA-N CC(OC)C   2-Methoxypropane; Ether, isopropyl methyl; i-C3H7OCH3; Isopropyl methyl ether; Isopryl; Methyl isopropyl ether; Propane, 2-methoxy-; ether
78831 C4H10O 1-Propanol, 2-methyl- InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3 ZXEKIIBDNHEJCQ-UHFFFAOYSA-N CC(C)CO   1-Propanol, 2-methyl-; 1-Hydroxymethylpropane; 2-Methyl-1-propanol; 2-Methylpropan-1-ol; 2-Methylpropanol; 2-Methylpropanol-1; 2-Methylpropyl alcohol; Alcool isobutylique; Butanol-iso; Fermentation butyl alcohol; Isobutanol; Isobutyl alcohol; Isobutylalkohol; iso-C4H9OH; Isopropylcarbinol; Rcra waste number U140; UN 1212
75650 C4H10O Ethanol, 1,1-dimethyl- InChI=1S/C4H10O/c1-4(2,3)5/h5H,1-3H3 DKGAVHZHDRPRBM-UHFFFAOYSA-N CC(C)(O)C   1,1-Dimethylethanol; 2-Methyl-2-propanol; 2-Methylpropan-2-ol; 2-Methylpropanol-2; 2-Propanol, 2-methyl-; Alcool butylique tertiaire; Butanol tertiaire; Ethanol, 1,1-Dimethyl-; Methanol, trimethyl-; NCI-C55367; t-Butanol; t-Butyl alchohol; t-Butyl hydroxide; tert-Butanol; tert-Butyl Alcohol; tert-Butyl hydroxide; tert-C4H9OH; Trimethylmethanol; Trimethylcarbinol; UN 1120
75650 C4H10O Ethanol, 1,1-dimethyl- InChI=1S/C4H10O/c1-4(2,3)5/h5H,1-3H3 DKGAVHZHDRPRBM-UHFFFAOYSA-N CC(C)(O)C   1,1-Dimethylethanol; 2-Methyl-2-propanol; 2-Methylpropan-2-ol; 2-Methylpropanol-2; 2-Propanol, 2-methyl-; Alcool butylique tertiaire; Butanol tertiaire; Ethanol, 1,1-Dimethyl-; Methanol, trimethyl-; NCI-C55367; t-Butanol; t-Butyl alchohol; t-Butyl hydroxide; tert-Butanol; tert-Butyl Alcohol; tert-Butyl hydroxide; tert-C4H9OH; Trimethylmethanol; Trimethylcarbinol; UN 1120
60297 C4H10O Ethoxy ethane InChI=1S/C4H10O/c1-3-5-4-2/h3-4H2,1-2H3 RTZKZFJDLAIYFH-UHFFFAOYSA-N CCOCC   1,1'-Oxybisethane; 3-Oxapentane; Aether; Anaesthetic ether; Anesthesia ether; Anesthetic ether; Diaethylaether; Diethyl ether; Diethyl oxide; Dwuetylowy eter; Etere etilico; Ethane, 1,1'-oxybis-; Ether ethylique; Ether, ethyl; Ethoxyethane; Ethyl ether; Ethyl ether, tech.; Ethyl oxide; Oxyde d'ethyle; Pronarcol; Rcra waste number U117; Solvent ether; UN 1155; ether
71363 C4H10O 1-Butanol InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3 LRHPLDYGYMQRHN-UHFFFAOYSA-N CCCCO   1-Butanol; 1-Butyl alcohol; 1-Hydroxybutane; Alcool butylique; Butan-1-ol; Butanol; Butanolen; Butanolo; Butyl alcohol; Butyl hydroxide; Butylowy alkohol; Butyric alcohol; CCS 203; Hemostyp; Methylolpropane; NA 1120; NBA; n-Butan-1-ol; n-Butanol; n-Butanolbutanolen; n-Butyl alcohol; n-C4H9OH; Propylcarbinol; Propylmethanol; Rcra waste number U031; UN 1120
71363 C4H10O 1-Butanol InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3 LRHPLDYGYMQRHN-UHFFFAOYSA-N CCCCO   1-Butanol; 1-Butyl alcohol; 1-Hydroxybutane; Alcool butylique; Butan-1-ol; Butanol; Butanolen; Butanolo; Butyl alcohol; Butyl hydroxide; Butylowy alkohol; Butyric alcohol; CCS 203; Hemostyp; Methylolpropane; NA 1120; NBA; n-Butan-1-ol; n-Butanol; n-Butanolbutanolen; n-Butyl alcohol; n-C4H9OH; Propylcarbinol; Propylmethanol; Rcra waste number U031; UN 1120
71363 C4H10O 1-Butanol cation InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3/q+1 CCC[CH2+]O  
15892236 C4H10O 2-Butanol, (.+/-.)- InChI=1S/C4H10O/c1-3-4(2)5/h4-5H,3H2,1-2H3 BTANRVKWQNVYAZ-UHFFFAOYSA-N C[C@H](O)CC   .+/-.-2-Butanol; 2-Butanol, (.+/-.)-; butan-2-ol; sec-Butyl Alcohol; sec-Butanol; Ethyl Methyl carbinol; Methyl ethyl carbinol; 1-Methyl-1-propanol; 1-Methylpropyl alcohol; 2-Hydroxybutane; sec-C4H9OH; Butane, 2-hydroxy-; Butanol-2; Butan-2-ol; 2-Butyl alcohol; s-Butyl alcohol; s-Butanol; 2-butanol
14874705 BF4- tetrafluoroboron anion InChI=1S/BF4/c2-1(3,4)5/q-1 ODGCEQLVLXJUCC-UHFFFAOYSA-N F[B-](F)(F)F  
13847659 F3NO Nitrogen trifluoride oxide InChI=1S/F3NO/c1-4(2,3)5 UDOZVPVDQKQJAP-UHFFFAOYSA-N FN(F)(F)=O   AMOX; Nitrogen fluoride oxide; Nitrogen Fluoride oxide (F3NO); Nitrogen fluoride oxide (NF3O); Nitrogen trifluoride oxide; Trifluoramine oxide; Trifluoroamine oxide
75730 CF4 Carbon tetrafluoride InChI=1S/CF4/c2-1(3,4)5 TXEYQDLBPFQVAA-UHFFFAOYSA-N FC(F)(F)F   Arcton 0; Carbon fluoride; Carbon fluoride (CF4); Carbon tetrafluoride; F 14; FC 14; Freon 14; Halocarbon 14; Halon 14; Methane, tetrafluoro-; Perfluoromethane; R 14; Refrigerant 14; Tetrafluoromethane; UN 1982
7789266 FNO3 Fluorine nitrate InChI=1S/FNO3/c1-5-2(3)4 VHFBTKQOIBRGQP-UHFFFAOYSA-N ON(=O)=O   Fluorine nitrate; FONO2; hypofluorous nitric anhydride
1493114 CF3OH trifluoromethanol InChI=1S/CHF3O/c2-1(3,4)5/h5H WZCZNEGTXVXAAS-UHFFFAOYSA-N OC(F)(F)F   Trifluoromethyl alcohol; Perfluoromethanol
359115 C2HF3 Trifluoroethylene InChI=1S/C2HF3/c3-1-2(4)5/h1H MIZLGWKEZAPEFJ-UHFFFAOYSA-N FC(F)=CF   Ethene, trifluoro-; Ethylene, trifluoro-; Ethylene trifluoride; Trifluoroethene; 1,1,2-Trifluoroethylene; 1,1,2-trifluoroethene
359115 C2HF3+ Trifluoroethylene cation InChI=1S/C2HF3/c3-1-2(4)5/h1H/q+1 DBOXQVIYQOEWRW-UHFFFAOYSA-N F[CH+][C](F)F  
420462 CH3CF3 Ethane, 1,1,1-trifluoro- InChI=1S/C2H3F3/c1-2(3,4)5/h1H3 UJPMYEOUBPIPHQ-UHFFFAOYSA-N CC(F)(F)F   1,1,1-Trifluoroethane; 1,1,1-Trifluoroform; Ethane, 1,1,1-trifluoro-; FC143a; Fluorocarbon fc143a; FREON 143; Methylfluoroform; R 143a
695808812 MgCO3 Magnesium Carbonate InChI=1S/CH2O3.Mg/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2 O=C1O[Mg]O1  
75763 Si(CH3)4 tetramethylsilane InChI=1S/C4H12Si/c1-5(2,3)4/h1-4H3 CZDYPVPMEAXLPK-UHFFFAOYSA-N C[Si](C)(C)C   tms; Silane, tetramethyl-; Silicon, tetramethyl-; Tetramethylsilicane; tetramethylsilane
7783611 SiF4 Silicon tetrafluoride InChI=1S/F4Si/c1-5(2,3)4 ABTOQLMXBSRXSM-UHFFFAOYSA-N F[Si](F)(F)F   Silane, tetrafluoro-; Silicon fluoride; Silicon fluoride (SiF4); Silicon tetrafluoride; Tetrafluorosilane; UN 1859; perfluorosilane
120434277 SiH3CCl3 (trichloromethyl)silane InChI=1S/CH3Cl3Si/c2-1(3,4)5/h5H3 DWAWYEUJUWLESO-UHFFFAOYSA-N [SiH3]C(Cl)(Cl)Cl  
14265442 PO4--- phosphate InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3 NBIIXXVUZAFLBC-UHFFFAOYSA-K O=P([O-])([O-])[O-]  
7664382 H3PO4 Phosphoric Acid InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4) NBIIXXVUZAFLBC-UHFFFAOYSA-N [O][P](O)(O)O  
13478201 F3PO Phosphoryl fluoride InChI=1S/F3OP/c1-5(2,3)4 FFUQCRZBKUBHQT-UHFFFAOYSA-N O=P(F)(F)F   Phosphorus oxyfluoride; Phosphoryl fluoride; Phosphoryl trifluoride; Trifluorophosphorus oxide; Trifluorophosphine oxide
14808798 SO4-- sulfate InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4)/p-2 QAOWNCQODCNURD-UHFFFAOYSA-L O=S([O-])([O-])=O   sulfate anion; sulfate
14996022 HSO4- bisulfate anion InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4)/p-1 QAOWNCQODCNURD-UHFFFAOYSA-M [O-]S(=O)(=O)O  
7664939 H2SO4 Sulfuric acid InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4) QAOWNCQODCNURD-UHFFFAOYSA-N OS(=O)(O)=O   Acide sulfurique; Acido solforico; BOV; Dipping acid; Hydgogen sulfate; Hydrogen sulfate; Matting acid; Nordhausen acid; Oil of vitriol; Schwefelsaeureloesungen; Spent sulfuric acid; Sulfuric Acid; Sulfuric acid, spent; Sulphuric acid; Vitriol brown oil; UN 2796; Vitriol, oil of; UN 1830; UN 1832; Zwavelzuuroplossingen
110021 C4H4S Thiophene InChI=1S/C4H4S/c1-2-4-5-3-1/h1-4H YTPLMLYBLZKORZ-UHFFFAOYSA-N C1=CC=CS1   CP 34; Divinylene sulfide; Furan, Thio-; Huile H50; Huile HSO; Thiacyclopentadiene; Thiaphene; Thiofen; Thiofuram; Thiofuran; Thiofurfuran; Thiole; Thiophen; Thiophene; Thiotetrole; USAF ek-1860; UN 2414
79196 CH5N3S Hydrazinecarbothioamide InChI=1S/CH5N3S/c2-1(5)4-3/h3H2,(H3,2,4,5) BRWIZMBXBAOCCF-UHFFFAOYSA-N NNC(N)=S   1-Amino-2-Thiourea; 1-Aminothiourea; 2-Thiosemicarbazide; Hydrazinecarbothioamide; Isothiosemicarbazide; N-Aminothiourea; Rcra waste number P116; Semicarbazide, 3-thio-; Semicarbazide, thio-; Thiocarbamoylhydrazine; Thiocarbamylhydrazine; Thiosemicarbazide; TSC; TSZ; USAF ek-1275
67710 C2H6O2S Dimethyl sulfone InChI=1S/C2H6O2S/c1-5(2,3)4/h1-2H3 HHVIBTZHLRERCL-UHFFFAOYSA-N C[S](C)(=O)=O   Dimethyl sulfone; Dimethyl sulphone; Methane, sulfonylbis-; Methyl sulfone; Methylsulfonylmethane; Sulphonylbismethane; (methylsulfonyl)methane
627510 CH2CHSCHCH2 Divinyl sulfide InChI=1S/C4H6S/c1-3-5-4-2/h3-4H,1-2H2 UIYCHXAGWOYNNA-UHFFFAOYSA-N C=CSC=C   Divinyl sulfide; Divinyl thioether; Ethene, 1,1'-thiobis-; Vinyl sulfide; divinylsulfane
1708323 C4H6S Thiophene, 2,5-dihydro- InChI=1S/C4H6S/c1-2-4-5-3-1/h1-2H,3-4H2 WURYWHAKEJHAOV-UHFFFAOYSA-N C1C=CCS1   2,5-Dihydrothiophene; Thiophene, 2,5-dihydro-
1120598 C4H6S Thiophene, 2,3-dihydro- InChI=1S/C4H6S/c1-2-4-5-3-1/h1,3H,2,4H2 OXBLVCZKDOZZOJ-UHFFFAOYSA-N C1CC=CS1   2,3-Dihydrothiophene; Thiophene, 2,3-dihydro-
3658808 CH3SSSCH3 dimethyl trisulfide InChI=1S/C2H6S3/c1-3-5-4-2/h1-2H3 YWHLKYXPLRWGSE-UHFFFAOYSA-N CSSSC   Trisulfide, dimethyl; 2,3,4-Trithiapentane; 1,3-Dimethyltrisulfane
109808 C3H8S2 1,3-Propanedithiol InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2 ZJLMKPKYJBQJNH-UHFFFAOYSA-N SCCCS   1,3-Dimercaptopropane; 1,3-Propanedimercaptan; 1,3-Propanedithiol; Dithiotrimethyleneglycol; NDR-132; Trimethylenedithioglycol; Trimethylene dimercaptan; Trimethylenedithiol; propane-1,3-dithiol
110010 C4H8S Thiophene, tetrahydro- InChI=1S/C4H8S/c1-2-4-5-3-1/h1-4H2 RAOIDOHSFRTOEL-UHFFFAOYSA-N C1CCCS1   Tetrahydrothiofen; Tetrahydrothiophen; Tetrahydrothiophene; Tetramethylene sulfide; Tetramethylene sulphide; Thiacyclopentane; Thilane; Thiofan; Thiolan; Thiolane; Thiophane; Thiophene, tetrahydro-; THT; UN 2412
75661 C(CH3)3SH 2-Propanethiol, 2-methyl- InChI=1S/C4H10S/c1-4(2,3)5/h5H,1-3H3 WMXCDAVJEZZYLT-UHFFFAOYSA-N CC(S)(C)C   1,1-Dimethylethanethiol; 2-Isobutanethiol; 2-Methyl-2-Propanethiol; 2-Propanethiol, 2-methyl-; t-Butyl mercaptan; tert-Butanethiol; tert-Butylmercaptan; tert-Butylthiol; tert-C4H9SH; 2-methylpropane-2-thiol
513440 CH2(SH)CH(CH3)CH3 1-Propanethiol, 2-methyl- InChI=1S/C4H10S/c1-4(2)3-5/h4-5H,3H2,1-2H3 BDFAOUQQXJIZDG-UHFFFAOYSA-N CC(C)CS   1-Propanethiol, 2-methyl-; 1-Isobutanethiol; 2-Methyl-1-propanethiol; Isobutanethiol; Isobutyl mercaptan; iso-C4H9SH; 2-methylpropane-1-thiol
513531 CH3CH(SH)CH2CH3 2-Butanethiol InChI=1S/C4H10S/c1-3-4(2)5/h4-5H,3H2,1-2H3 LOCHFZBWPCLPAN-UHFFFAOYSA-N C[C@H](S)CC   1-Methyl-1-propanethiol; 2-Mercaptobutane; 2-Butanethiol; 2-Butyl mercaptan; sec-Butanethiol; sec-Butyl mercaptan; sec-Butyl mercaptan; sec-Butyl thioalcohol; sec-Butyl thiol; sec-C4H9SH; Secondary butylmercaptan; butane-2-thiol
352932 C2H5SC2H5 Diethyl sulfide InChI=1S/C4H10S/c1-3-5-4-2/h3-4H2,1-2H3 LJSQFQKUNVCTIA-UHFFFAOYSA-N CCSCC   1,1'-Thiobisethane; 3-Thiapentane; Diethyl sulfide; Diethyl sulphide; Diethyl thioether; Diethylsulfid; Ethane, 1,1'-thiobis-; Ethyl monosulfide; Ethyl sulfide; Ethyl thioether; Ethylthioethane; Sulfodor; Thioethyl ether; UN 2375; diethylsulfane
1551219 CH3C(SCH3)HCH3 Propane, 2-(methylthio)- InChI=1S/C4H10S/c1-4(2)5-3/h4H,1-3H3 ROSSIHMZZJOVOU-UHFFFAOYSA-N CC(C)SC   2-(Methylthio)propane; 3-Methyl-2-thiabutane; Isopropyl methyl sulfide; Isopropyl methyl sulphide; Methyl isopropyl sulfide; Propane, 2-(methylthio)-; Sulfide, isopropyl methyl; isopropyl(methyl)sulfane
2699798 SO2F2 Sulfuryl fluoride InChI=1S/F2O2S/c1-5(2,3)4 OBTWBSRJZRCYQV-UHFFFAOYSA-N O=S(F)(F)=O   Sulfonyl fluoride; Sulfur dioxide difluoride; Sulfur fluoride oxide; Sulfuric oxyfluoride; Fluorure de sulfuryle; Sulphuryl fluoride; Sulfuryl difluoride; sulphuryl difluoride
7783600 SF4 Sulfur tetrafluoride InChI=1S/F4S/c1-5(2,3)4 QHMQWEPBXSHHLH-UHFFFAOYSA-N FS(F)(F)F   Tetrafluorosulfurane; UN 2418; Sulfur fluoride; Sulfur tetrafluoride
7789211 HSO3F Fluorosulfonic acid InChI=1S/FHO3S/c1-5(2,3)4/h(H,2,3,4) UQSQSQZYBQSBJZ-UHFFFAOYSA-N FS(=O)(O)=O   Fluorosulfonic acid; Fluorosulfuric-acid-; Fluorosulphonic-acid-; Fluosulfonic acid; UN 1777; sulfurofluoridic acid
7791255 SO2Cl2 Sulfuryl chloride InChI=1S/Cl2O2S/c1-5(2,3)4 YBBRCQOCSYXUOC-UHFFFAOYSA-N O=S(Cl)(Cl)=O   Chlorosulfuric acid; Sulfonyl chloride; Sulfuric chloride; Sulfuric oxychloride; Sulfuryl chloride; Sulphuryl-chloride-; UN 1834; sulfuryl dichloride
7616946 ClFO3 Perchloryl fluoride InChI=1S/ClFO3/c2-1(3,4)5 XHFXMNZYIKFCPN-UHFFFAOYSA-N O=Cl(=O)(F)=O   Chlorine fluoride oxide; Chlorine fluoride oxide (ClO3F); Chlorine oxyfluoride; Chlorine oxyfluoride (ClO3F); Perchloryl fluoride; Perchloryl fluoride ((ClO3)F); Trioxychlorofluoride; perchloric fluoride
75694 CFCl3 Trichloromonofluoromethane InChI=1S/CCl3F/c2-1(3,4)5 CYRMSUTZVYGINF-UHFFFAOYSA-N ClC(Cl)(Cl)F   Algofrene Type 1; Arcton 11; Arcton 9; Chlorofluoromethane (CCl3F); Daiflon 11; Daiflon S 1; Electro-CF 11; F 11; F 11B; FC 11; FC 11, Halocarbon; FKW 11; Fluorocarbon 11; Fluorochloroform; Fluorotrichloromethane; Freon 11; Freon MF; Freon R 11; Frigen 11; Frigen 11A; Frigen S 11; Genetron 11; Halon 11; Isceon 131; Isotron 11; Kaltron 11; Khladon 11; Ledon 11; Methane, trichlorofluoro-; Monofluorotrichloromethane; Propellant 11; R 11; R 11, Halocarbon; Refrigerant 11; Refrigerant R11; Trichloromonofluoromethane; Trichlorofluoromethane; Triclorofluormethane
75718 CF2Cl2 difluorodichloromethane InChI=1S/CCl2F2/c2-1(3,4)5 PXBRQCKWGAHEHS-UHFFFAOYSA-N ClC(F)(F)Cl   Algofrene Type 2; Arcton 12; Arcton 6; Chlorofluoromethane (CCl2F2); Dichlorodifluoromethane; Difluorodichloromethane; Dwuchlorodwufluorometan; Electro-CF 12; Eskimon 12; F 12; FC 12; Fluorocarbon 12; Freon 12; Freon F-12; Frigen 12; Genetron 12; Halon; Halon 122; Isceon 122; Isotron 12; Kaiser chemicals 12; Ledon 12; Methane, dichlorodifluoro-; Propellant 12; R 12; R 12, Refrigerant; Rcra waste number U075; Refrigerant 12; Ucon 12; Ucon 12/halocarbon 12; UN 1028
75729 CF3Cl Methane, chlorotrifluoro- InChI=1S/CClF3/c2-1(3,4)5 AFYPFACVUDMOHA-UHFFFAOYSA-N FC(F)(Cl)F   Arcton 3; Chlorotrifluoromethane; F 13; FC 13; Freon 13; Frigen 13; Genetron 13; Halocarbon 13/ucon 13; Methane, chlorotrifluoro-; Monochlorotrifluoromethane; R 13; Refrigerant 13; Trifluoromethyl Chloride; UN 1022; Trifluorochloromethane; Trifluoromonochlorocarbon
56235 CCl4 Carbon tetrachloride InChI=1S/CCl4/c2-1(3,4)5 VZGDMQKNWNREIO-UHFFFAOYSA-N ClC(Cl)(Cl)Cl   Benzenoform; Benzinoform; Carbon chloride; Carbon chloride (CCl4); Carbon tet; Carbon Tetrachloride; Carbona; Chlorid uhlicity; Czterochlorek wegla; ENT 27164; ENT 4,705; Fasciolin; Flukoids; Freon 10; Halon 104; Methane tetrachloride; Methane, tetrachloro-; Necatorina; Necatorine; Perchloromethane; R 10; Rcra waste number U211; Tetrachloorkoolstof; Tetrachloormetaan; Tetrachlorkohlenstoff, tetra; Tetrachlormethan; Tetrachlorocarbon; Tetrachloromethane; Tetrachlorure de carbone; Tetraclorometano; Tetracloruro di carbonio; Tetrafinol; Tetraform; Tetrasol; UN 1846; Vermoestricid; Univerm
56235 CCl4+ Carbon tetrachloride cation InChI=1S/CCl4/c2-1(3,4)5/q+1 ClC(Cl)([Cl+])Cl  
14797730 ClO4- perchlorate anion InChI=1S/ClHO4/c2-1(3,4)5/h(H,2,3,4,5)/p-1 VLTRZXGMWDSKGL-UHFFFAOYSA-M O=Cl(=O)([O-])=O   perchlorate
14545723 ClONO2 Chlorine nitrate InChI=1S/ClNO3/c1-5-2(3)4 XYLGPCWDPLOBGP-UHFFFAOYSA-N ClO[N]([O])=O  
10025873 Cl3PO Phosphoryl chloride InChI=1S/Cl3OP/c1-5(2,3)4 XHXFXVLFKHQFAL-UHFFFAOYSA-N O=P(Cl)(Cl)Cl   Fosforoxychlorid; Oxychlorid fosforecny; Phosphoric chloride; Phosphoric trichloride; Phosphorous oxychloride; Phosphorus chloride oxide (POCl3); Phosphorus oxide chloride; Phosphorus oxide trichloride; Phosphorus oxychloride; Phosphorus oxytrichloride; Phosphorus(V) trichloride oxide; Phosphoryl chloride; Phosphoryl trichloride; Trichlorophosphine oxide; Trichlorophosphorus oxide; UN 1810
10026047 SiCl4 Silane, tetrachloro- InChI=1S/Cl4Si/c1-5(2,3)4 FDNAPBUWERUEDA-UHFFFAOYSA-N Cl[Si](Cl)(Cl)Cl   Chlorid kremicity; Extrema; Silane, tetrachloro-; Silicio(tetracloruro di); Silicium(tetrachlorure de); Siliciumtetrachlorid; Siliciumtetrachloride; Silicon chloride; Silicon chloride (SiCl4); Silicon tetrachloride; Silicon(IV) chloride; Tetrachlorosilane; Tetrachlorosilicon; Tetrachlorure de silicium; UN 1818; perchlorosilane
79016 CHClCCl2 Trichloroethylene InChI=1S/C2HCl3/c3-1-2(4)5/h1H XSTXAVWGXDQKEL-UHFFFAOYSA-N ClC(Cl)=CCl   1,1,2-Trichloroethene; 1,1,2-Trichloroethylene; 1,1-Dichloro-2-chloroethylene; 1,2,2-Trichloroethylene; 1-Chloro-2,2-dichloroethylene; Acetylene trichloride; Algylen; Anamenth; Benzinol; Blacosolv; Blancosolv; Cecolene; Chlorilen; Chlorylea; Chlorylen; Chorylen; Circosolv; Crawhaspol; Densinfluat; Dow-tri; Dukeron; Ethene, trichloro-; Ethinyl trichloride; Ethylene trichloride; Ethylene, trichloro-; Fleck-flip; Flock flip; Fluate; Gemalgene; Germalgene; Lanadin; Lethurin; Narcogen; Narkogen; Narkosoid; NCI-C04546; Nialk; Perm-A-chlor; Perm-A-clor; Petzinol; Philex; Rcra waste number U228; TCE; Threthylen; Threthylene; Trethylene; Tri; Triad; Trial; Triasol; Trichlooretheen; Trichloorethyleen, tri; Trichloraethylen, tri; Trichloroethene; Trichloroethylene; Tricloretene; Tricloroetilene; Trielin; Trielina; Trichloraethen; Trichloran; Trichloren; Trichlorethene; Trichlorethylene; Trichlorethylene, tri; Tri-Clene; Trielene; Trieline; Trimar; Westrosol; Triline; Triklone; Trilen; Trilene; Tri-plus; UN 1710; Vitran; Triol; Vestrol; Tri-plus M
7601903 HClO4 perchloric acid InChI=1S/ClHO4/c2-1(3,4)5/h(H,2,3,4,5) VLTRZXGMWDSKGL-UHFFFAOYSA-N O=Cl(=O)(O)=O  
79027 CHCl2CHO dichloroacetaldehyde InChI=1S/C2H2Cl2O/c3-2(4)1-5/h1-2H NWQWQKUXRJYXFH-UHFFFAOYSA-N O=CC(Cl)Cl   Acetaldehyde,dichloro-; 2,2-Dichloroacetaldehyde; Chloroaldehyde; Acetaldehyde, 2,2-dichloro-; Chloraldehyde; a,a-Dichloroacetaldehyde
79005 CH2ClCHCl2 1,1,2-trichloroethane InChI=1S/C2H3Cl3/c3-1-2(4)5/h2H,1H2 UBOXGVDOUJQMTN-UHFFFAOYSA-N ClCC(Cl)Cl   1,1,2-Trichlorethane; ethane trichloride; Ethane, 1,1,2-trichloro-; Trichloroethane; 1,1,2-Trichloroethane; CHCl2CH2Cl; 1,2,2-Trichloroethane
75683 CH3CF2Cl 1-Chloro-1,1-Difluoroethane InChI=1S/C2H3ClF2/c1-2(3,4)5/h1H3 BHNZEZWIUMJCGF-UHFFFAOYSA-N CC(F)(Cl)F   Ethane, 1-chloro-1,1-difluoro-; Freon 142; Freon 142b; FC 142b; R 142b; 1,1-Difluoro-1-chloroethane; CFC 142b; Chlorodifluoroethane; Difluoromonochloroethane; UN 2517; 1-chloro-1,1-difluoroethane
75796 SiCl3CH3 methyltrichlorosilane InChI=1S/CH3Cl3Si/c1-5(2,3)4/h1H3 JLUFWMXJHAVVNN-UHFFFAOYSA-N C[Si](Cl)(Cl)Cl   Silane, trichloromethyl-; Monomethyltrichlorosilane; Trichloromethylsilane; Methylsilicochloroform; Silane, methyltrichloro-; UN 1250
71556 CH3CCl3 Ethane, 1,1,1-trichloro- InChI=1S/C2H3Cl3/c1-2(3,4)5/h1H3 UOCLXMDMGBRAIB-UHFFFAOYSA-N CC(Cl)(Cl)Cl   α-T; α-Trichloroethane; 1,1,1-TCE; 1,1,1-Trichloorethaan; 1,1,1-Trichloraethan; 1,1,1-Trichloroethane; 1,1,1-Tricloroetano; Aerothene TT; Chloroetene; Chloroethene; Chloroethene NU; Chloroform, methyl-; Chlorotene; Chlorothane NU; Chlorothene; Chlorothene NU; Chlorothene sm; Chlorothene VG; Chlorothene, inhibited; Chlorten; Ethana nu; Ethane, 1,1,1-trichloro-; Ici-cf 2; Inhibisol; Methylchloroform; Methyltrichloromethane; NCI-C04626; Rcra waste number U226; Solvent 111; Strobane; Tafclean; Trichloro-1,1,1-ethane; Trichloromethylmethane; Tri-ethane; Trichloroethane; UN 2831; alpha-T; alpha-Trichloroethane
1717006 CH3CFCl2 1,1-Dichloro-1-fluoroethane InChI=1S/C2H3Cl2F/c1-2(3,4)5/h1H3 FRCHKSNAZZFGCA-UHFFFAOYSA-N CC(F)(Cl)Cl   Ethane, 1,1-dichloro-1-fluoro-; Freon 141; Dichlorofluoroethane; Freon 141b; HCFC-141b; R 141b; 1,1-dichloro-1-fluoroethane
106898 C3H5ClO Oxirane, (chloromethyl)- InChI=1S/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H2 BRLQWZUYTZBJKN-UHFFFAOYSA-N ClC[C@H]1OC1   2-(Chloromethyl)oxirane; α-Epichlorohydrin; γ-Chloropropylene oxide; 1,2-Epoxy-3-chloropropane; 1-Chloor-2,3-epoxy-propaan; 1-Chlor-2,3-epoxy-propan; 1-Chloro-2,3-Epoxypropane; 1-Cloro-2,3-epossipropano; 2,3-Epoxypropyl chloride; (Chloromethyl)ethylene oxide; (Chloromethyl)oxirane; (DL)-α-Epichlorohydrin; 3-Chloro-1,2-epoxypropane; 3-Chloro-1,2-propylene oxide; 3-Chloropropene-1,2-oxide; 3-Chloropropylene oxide; Alyl chloride oxide; Chloropropylene oxide; ECH; Epichloorhydrine; Epichlorhydrin; Epichlorhydrine; Epichlorohydrin; Epichlorohydryna; Epichlorophydrin; Epicloridrina; Glycerol epichlorhydrin; Glycerol epichlorohydrin; Glycidyl chloride; Oxirane, (chloromethyl)-; Oxirane, 2-(chloromethyl); Propane, 1-chloro-2,3-epoxy-; Rcra waste number U041; SKEkhG; UN 2023; alpha-Epichlorohydrin; gamma-Chloropropylene oxide
78875 CH2ClCHClCH3 Propane, 1,2-dichloro- InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3 KNKRKFALVUDBJE-UHFFFAOYSA-N C[C@@H](Cl)CCl   α,β-dichloropropane; α,β-Propylene dichloride; 1,2-Dichloropropane; Bichlorure de propylene; Chlorinated C3 hydrocarbons; D-d Mixture; Dichloropropane; Dwuchloropropan; ENT 15,406; NCI-C55141; Nemex; Propane, 1,2-dichloro-; Propylene chloride; Propylene dichloride; Rcra waste number U083; Vidden D; alpha,beta-dichloropropane; alpha,beta-Propylene dichloride
594207 CH3CCl2CH3 Propane, 2,2-dichloro- InChI=1S/C3H6Cl2/c1-3(2,4)5/h1-2H3 ZEOVXNVKXIPWMS-UHFFFAOYSA-N CC(Cl)(Cl)C   2,2-Dichloropropane; Dimethyldichloromethane; Propane, 2,2-dichloro-
563520 CH2CHCHClCH3 1-Butene, 3-chloro- InChI=1S/C4H7Cl/c1-3-4(2)5/h3-4H,1H2,2H3 VZGLVCFVUREVDP-UHFFFAOYSA-N C=C[C@H](Cl)C   1-Methylallyl chloride; α-Methallyl chloride; α-Methylallyl chloride; γ-Chloro-α-butylene; 1-Butene, 3-chloro-; 2-Chloro-3-butene; 3-Chloro-1-butene; alpha-Methallyl chloride; alpha-Methylallyl chloride; gamma-Chloro-alpha-butylene; 3-chlorobut-1-ene
591979 CH2ClCHCHCH3 2-Butene, 1-chloro- InChI=1S/C4H7Cl/c1-2-3-4-5/h2-3H,4H2,1H3 YTKRILODNOEEPX-UHFFFAOYSA-N C/C=C/CCl   α-Chloro-β-butylene; γ-Methallyl chloride; γ-Methylallyl chloride; 1-Chloro-2-butene; 2-Butene, 1-chloro-; 2-Butenyl chloride; Crotyl chloride; alpha-Chloro-beta-butylene; gamma-Methallyl chloride; gamma-Methylallyl chloride; (E)-1-chlorobut-2-ene
927731 CH2CHCH2CH2Cl 1-Butene, 4-chloro- InChI=1S/C4H7Cl/c1-2-3-4-5/h2H,1,3-4H2 WKEVRZCQFQDCIR-UHFFFAOYSA-N C=CCCCl   1-Butene, 4-chloro-; 4-chlorobut-1-ene
2211703 CH2CClCH2CH3 1-Butene, 2-chloro- InChI=1S/C4H7Cl/c1-3-4(2)5/h2-3H2,1H3 HSEFPJMMKNHABB-UHFFFAOYSA-N C=C(Cl)CC   1-Butene, 2-chloro-; 2-chlorobut-1-ene
4628211 CH3CClCHCH3 2-Butene, 2-chloro-, (Z)- InChI=1S/C4H7Cl/c1-2-3-4-5/h2-3H,4H2,1H3/b3-2- YTKRILODNOEEPX-IHWYPQMZSA-N C/C(Cl)=C/C   2-Butene, 1-chloro-, (Z)-; (Z)-2-chlorobut-2-ene
4894615 CH3CClCHCH3 2-Butene, 2-chloro-, (E)- InChI=1S/C4H7Cl/c1-2-3-4-5/h2-3H,4H2,1H3/b3-2+ YTKRILODNOEEPX-NSCUHMNNSA-N C/C(Cl)=C\C   2-Butene, 1-chloro-, (E)-; (E)-2-chlorobut-2-ene
7611861 CHClCHCH2CH3 (Z)-1-Chloro-1-butene InChI=1S/C4H7Cl/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3- DUDKKPVINWLFBI-ARJAWSKDSA-N CC/C=C\Cl   1-Butene, 1-chloro-, (Z)-; (Z)-1-chlorobut-1-ene
7611872 CHClCHCH2CH3 (E)-1-Chloro-1-butene InChI=1S/C4H7Cl/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3+ DUDKKPVINWLFBI-ONEGZZNKSA-N CC/C=C/Cl   1-Butene, 1-chloro-, (E)-; (E)-1-chlorobut-1-ene
507200 CH3CCl(CH3)CH3 Propane, 2-chloro-2-methyl- InChI=1S/C4H9Cl/c1-4(2,3)5/h1-3H3 NBRKLOOSMBRFMH-UHFFFAOYSA-N CC(C)(Cl)C   2-Methyl-2-chloropropane; 2-Methyl-2-propyl chloride; 2-Chloro-2-methylpropane; 2-Chloroisobutane; Chlorotrimethylmethane; n-Propylcarbinyl chloride; Propane, 2-chloro-2-methyl-; tert-Butyl Chloride; tert-C4H9Cl; Tertiary-butyl chloride; Trimethylchloromethane
78864 CH3CHClCH2CH3 Butane, 2-chloro- InChI=1S/C4H9Cl/c1-3-4(2)5/h4H,3H2,1-2H3 BSPCSKHALVHRSR-UHFFFAOYSA-N C[C@H](Cl)CC   1-Methylpropyl chloride; 2-Chlorobutane; Butane, 2-chloro-; sec-Butyl Chloride; sec-C4H9Cl; UN 1127
109693 CH2ClCH2CH2CH3 Butane, 1-chloro- InChI=1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3 VFWCMGCRMGJXDK-UHFFFAOYSA-N CCCCCl   1-Chlorobutane; Butane, 1-chloro-; Butyl chloride; Chlorure de butyle; NBC wormer; n-Butyl chloride; n-C4H9Cl; NCI-C06155; n-Propylcarbinyl chloride; Sure Shot; UN 1127
471341 CaCO3 Calcium Carbonate InChI=1S/CH2O3.Ca/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2 VTYYLEPIZMXCLO-UHFFFAOYSA-L O=C1O[Ca]O1  
471341 CaCO3 Calcium Carbonate InChI=1S/CH2O3.Ca/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2 VTYYLEPIZMXCLO-UHFFFAOYSA-L O=C1O[Ca]O1  
7550450 TiCl4 Titanium tetrachloride InChI=1S/4ClH.Ti/h4*1H;/q;;;;+4/p-4 XJDNKRIXUMDJCW-UHFFFAOYSA-J Cl[Ti](Cl)(Cl)Cl   Titanium chloride; Titanium(IV) chloride; Titanic chloride; Tetrachlorotitanium; Titantetrachlorid; Tetrachlorure de titane
7783633 TiF4 Titanium tetrafluoride InChI=1S/4FH.Ti/h4*1H;/q;;;;+4/p-4 XROWMBWRMNHXMF-UHFFFAOYSA-J F[Ti](F)(F)F  
7783586 GeF4 Germanium tetrafluoride InChI=1S/F4Ge/c1-5(2,3)4 PPMWWXLUCOODDK-UHFFFAOYSA-N F[Ge](F)(F)F   tetrafluorogermane; perfluorogermane
10038989 GeCl4 Germanium Tetrachloride InChI=1S/Cl4Ge/c1-5(2,3)4 IEXRMSFAVATTJX-UHFFFAOYSA-N Cl[Ge](Cl)(Cl)Cl   Germanium chloride; Germanium(IV) chloride; Germane, tetrachloro-; Germanium, tetrachloro-
7783086 H2SeO4 Selenic acid InChI=1S/H2O4Se/c1-5(2,3)4/h(H2,1,2,3,4) QYHFIVBSNOWOCQ-UHFFFAOYSA-N O=[Se](=O)(O)O  
7783086 H2SeO4 Selenic acid InChI=1/H2O4Se/c1-5(2,3)4/h(H2,1,2,3,4)/f/h1-2H QYHFIVBSNOWOCQ-KRMADWITNA-N O=[Se](=O)(O)O  
353593 CBrClF2 Methane, bromochlorodifluoro- InChI=1S/CBrClF2/c2-1(3,4)5 MEXUFEQDCXZEON-UHFFFAOYSA-N FC(Br)(Cl)F   Bromochlorodifluoromethane; Difluorochlorobromomethane; Chlorodifluoromonobromomethane; Chlorodifluorobromomethane; Chlorobromodifluoromethane
558134 CBr4 Carbon tetrabromide InChI=1S/CBr4/c2-1(3,4)5 HJUGFYREWKUQJT-UHFFFAOYSA-N BrC(Br)(Br)Br   Tetrabromomethane; Methane, tetrabromo-; Methane tetrabromide; Carbon bromide; perbromomethane
75616 CBr2F2 Methane, dibromodifluoro- InChI=1S/CBr2F2/c2-1(3,4)5 AZSZCFSOHXEJQE-UHFFFAOYSA-N FC(Br)(Br)F   Dibromodifluoromethane; Difluorodibromomethane
75627 CBrCl3 Methane, bromotrichloro- InChI=1S/CBrCl3/c2-1(3,4)5 XNNQFQFUQLJSQT-UHFFFAOYSA-N ClC(Cl)(Br)Cl   Bromotrichloromethane; Carbon bromotrichloride; Monobromotrichloromethane; Trichlorobromomethane; Carbon trichlorobromide; Trichloromethyl bromide
75638 CF3Br Bromotrifluoromethane InChI=1S/CBrF3/c2-1(3,4)5 RJCQBQGAPKAMLL-UHFFFAOYSA-N FC(Br)(F)F   Methane, bromotrifluoro-; Monobromotrifluoromethane; Halon 1301; Trifluorobromomethane; Trifluoromethyl Bromide; Trifluoromonobromomethane; Refrigerant 13b1; F 13B1; Fluorocarbon 1301; Freon 13B1; UN 1009; bromotrifluoromethane
40423141 BrONO2 Bromine nitrate InChI=1S/BrNO3/c1-5-2(3)4 RRTWEEAEXPZMPY-UHFFFAOYSA-N [O]N([O])OBr  
359080 CHBrCF2 1-Bromo-2,2-difluoroethylene InChI=1S/C2HBrF2/c3-1-2(4)5/h1H QZGNGBWAMYFUST-UHFFFAOYSA-N BrC=C(F)F   Ethene, 2-bromo-1,1-difluoro-; 2-Bromo-1,1-difluoroethene; 2-Bromo-1,1-difluoroethylene
2311140 CH3CBr3 1,1,1-tribromoethane InChI=1S/C2H3Br3/c1-2(3,4)5/h1H3 ZDUOUNIIAGIPSD-UHFFFAOYSA-N CC(Br)(Br)Br  
2314978 CF3I trifluoroiodomethane InChI=1S/CF3I/c2-1(3,4)5 VPAYJEUHKVESSD-UHFFFAOYSA-N IC(F)(F)F   Iodotrifluoromethane; Perfluoromethyl iodide; Methane, trifluoroiodo-
3161997 C6H2 hexatriyne InChI=1S/C6H2/c1-3-5-6-4-2/h1-2H MZHROOGPARRVHS-UHFFFAOYSA-N C#CC#CC#C  
462806 C6H4 Benzyne InChI=1S/C6H4/c1-2-4-6-5-3-1/h1-4H KLYCPFXDDDMZNQ-UHFFFAOYSA-N C1=CC#CC=C1   1,3-Cyclohexadien-5-yne; cyclohexa-1,3-dien-5-yne; o-Benzyne; 1,2-Dehydrobenzene
16668670 C6H4 (Z)-Hexa-1,5-diyne-3-ene InChI=1S/C6H4/c1-3-5-6-4-2/h1-2,5-6H/b6-5- KIWAUQFHKHLABA-WAYWQWQTSA-N C#C/C=C\C#C   (Z)-HC#CCH=CHC#CH; (Z)-Hexa-1,5-diyne-3-ene; 3-Hexene-1,5-diyne, (Z)-; (Z)-hexa-3-en-1,5-diyne
16668681 C6H4 (E)-Hexa-1,5-diyne-3-ene InChI=1S/C6H4/c1-3-5-6-4-2/h1-2,5-6H/b6-5+ KIWAUQFHKHLABA-AATRIKPKSA-N C#C/C=C/C#C   (E)-HC#CCH=CHC#CH; (E)-Hexa-1,5-diyne-3-ene; 3-Hexene-1,5-diyne, (E)-; (E)-hexa-3-en-1,5-diyne
2396012 C6H5- phenyl anion InChI=1S/C6H5/c1-2-4-6-5-3-1/h1-5H/q-1 BJISZDCMBMQNIY-UHFFFAOYSA-N [C-]1=CC=CC=C1   phenide anion
2396012 C6H5 phenyl InChI=1S/C6H5/c1-2-4-6-5-3-1/h1-5H CIUQDSCDWFSTQR-UHFFFAOYSA-N [C]1=CC=CC=C1   phenyl
3227905 C6H6 Trimethylenecycopropane InChI=1S/C6H6/c1-4-5(2)6(4)3/h1-3H2 UPWZWQGQRNPKTE-UHFFFAOYSA-N C=C(C1=C)C1=C  
2809690 C6H6 2,4-Hexadiyne InChI=1S/C6H6/c1-3-5-6-4-2/h1-2H3 PCTCNWZFDASPLA-UHFFFAOYSA-N CC#CC#CC   2,4-Hexadiyne; Dimethylbutadiyne; Dimethyldiacetylene; Hexa-2,4-diyne
2809690 C6H6 2,4-Hexadiyne InChI=1S/C6H6/c1-3-5-6-4-2/h1-2H3 PCTCNWZFDASPLA-UHFFFAOYSA-N CC#CC#CC   2,4-Hexadiyne; Dimethylbutadiyne; Dimethyldiacetylene; Hexa-2,4-diyne
821089 C6H6 Hexa-1,5-diene-3-yne InChI=1S/C6H6/c1-3-5-6-4-2/h3-4H,1-2H2 AUBDSFLQOBEOPX-UHFFFAOYSA-N C=CC#CC=C  
71432 C6H6 Benzene InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H UHOVQNZJYSORNB-UHFFFAOYSA-N C1=CC=CC=C1   [6]Annulene; Benzeen; Benzen; Benzene; Benzin; Benzine; Benzol; Benzole; Benzolene; Benzolo; Bicarburet of hydrogen; Carbon oil; Coal naphtha; Cyclohexatriene; Fenzen; Mineral naphtha; Motor benzol; NCI-C55276; Nitration benzene; Phene; Phenyl hydride; Pyrobenzol; Pyrobenzole; Rcra waste number U019; UN 1114
29776963 C6H6 1,2,4,5-Hexatetraene InChI=1S/C6H6/c1-3-5-6-4-2/h5-6H,1-2H2 ROAKNVNVSBKPLL-UHFFFAOYSA-N C=C=CC=C=C  
30830207 C6H8 Bicyclo[2.2.0]hex-1(4)-ene InChI=1S/C6H8/c1-2-6-4-3-5(1)6/h1-4H2 XIEBQIWVIRKPGE-UHFFFAOYSA-N C12=C(CC2)CC1   Bicyclo[2.2.0]hex-1(4)-ene
59660649 C6H8 (Z)-hexa-2,3,4-triene InChI=1S/C6H8/c1-3-5-6-4-2/h3-4H,1-2H3/b4-3- UCAJIFZNHMIWOD-ARJAWSKDSA-N CC=C=C=CC   (Z)-CH3CH=C=C=CHCH3; hexatriene; (Z)-hexa-2,3,4-triene; cis-2,3,4-Hexatriene
59660650 C6H8 (E)-hexa-2,3,4-triene InChI=1S/C6H8/c1-3-5-6-4-2/h3-4H,1-2H3/b4-3+ UCAJIFZNHMIWOD-ONEGZZNKSA-N CC=C=C=CC   2,3,4-Hexatriene, (E)-; (E)-CH3CH=C=C=CHCH3; hexatriene; (E)-hexa-2,3,4-triene; trans-2,3,4-Hexatriene
592574 C6H8 1,3-Cyclohexadiene InChI=1S/C6H8/c1-2-4-6-5-3-1/h1-4H,5-6H2 MGNZXYYWBUKAII-UHFFFAOYSA-N C1=CC=CCC1   1,3-Cyclohexadiene; Cyclohexa-1,3-diene; cyclohexadiene
592574 C6H8 1,3-Cyclohexadiene InChI=1S/C6H8/c1-2-4-6-5-3-1/h1-4H,5-6H2 MGNZXYYWBUKAII-UHFFFAOYSA-N C1=CC=CCC1   1,3-Cyclohexadiene; Cyclohexa-1,3-diene; cyclohexadiene
628411 C6H8 1,4-Cyclohexadiene InChI=1S/C6H8/c1-2-4-6-5-3-1/h1-2,5-6H,3-4H2 UVJHQYIOXKWHFD-UHFFFAOYSA-N C1=CCC=CC1   1,4-Cyclohexadiene; 1,4-Dihydrobenzene; Cyclohexa-1,4-diene; cyclohexadiene
822413 C6H8 Bicyclo[2.1.1]hex-2-ene InChI=1S/C6H8/c1-2-6-3-5(1)4-6/h1-2,5-6H,3-4H2 YWDBHFZUBPOPRQ-UHFFFAOYSA-N [C@@H]1(C2)C=C[C@H]2C1  
821078 C6H8 (E)-hexa-1,3,5-triene InChI=1S/C6H8/c1-3-5-6-4-2/h3-6H,1-2H2/b6-5+ AFVDZBIIBXWASR-AATRIKPKSA-N C=C/C=C/C=C   1,3,5-Hexatriene, (E)-; 1,3,5-Hexatriene, trans-; (E)-1,3,5-Hexatriene; (E)-CH2=CHCH=CHCH=CH2; trans-1,3,5-Hexatriene; trans-Hexatriene; trans-trans-Hexatriene; hexatriene; (E)-hexa-1,3,5-triene
694019 C6H8 Bicyclo[3.1.0]hex-2-ene InChI=1S/C6H8/c1-2-5-4-6(5)3-1/h1-2,5-6H,3-4H2 BAOZQZPGQWXJOW-UHFFFAOYSA-N [C@@H]12C=CC[C@@H]1C2   Bicyclo(3.1.0)hex-2-ene; bicyclo[3.1.0]hex-2-ene
930267 C6H8 3-Methylenecyclopentene InChI=1S/C6H8/c1-6-4-2-3-5-6/h2,4H,1,3,5H2 YWQLRBQGXHZJCF-UHFFFAOYSA-N C=C1C=CCC1   3-Methylenecyclopentene; Cyclopentene,3-methylene-; 3-methylenecyclopent-1-ene
2612466 C6H8 (Z)-hexa-1,3,5-triene InChI=1S/C6H8/c1-3-5-6-4-2/h3-6H,1-2H2/b6-5- AFVDZBIIBXWASR-WAYWQWQTSA-N C=C/C=C\C=C   1,3,5-Hexatriene, (Z)-; 1,3,5-Hexatriene, cis-; (Z)-1,3,5-Hexatriene; (Z)-CH2=CHCH=CHCH=CH2; cis-1,3,5-Hexatriene; cis-Hexatriene; hexatriene; (Z)-hexa-1,3,5-triene
5194503 C6H10 2,4-Hexadiene, (E,Z)- InChI=1S/C6H10/c1-3-5-6-4-2/h3-6H,1-2H3/b5-3-,6-4+ APPOKADJQUIAHP-CIIODKQPSA-N C/C=C/C=C\C   2,4-Hexadiene, (E,Z)-; (E),(Z)-CH3CH=CHCH=CHCH3; cis,trans-2,4-Hexadiene; (2Z,4E)-hexa-2,4-diene
5194514 C6H10 2,4-Hexadiene, (E,E)- InChI=1S/C6H10/c1-3-5-6-4-2/h3-6H,1-2H3/b5-3+,6-4+ APPOKADJQUIAHP-GGWOSOGESA-N C/C=C/C=C/C   2,4-Hexadiene, (E,E)-; (E),(E)-CH3CH=CHCH=CHCH3; cis,cis-2,4-Hexadiene; trans,trans-2,4-Hexadiene; (2E,4E)-hexa-2,4-diene
6108618 C6H10 2,4-Hexadiene, (Z,Z)- InChI=1S/C6H10/c1-3-5-6-4-2/h3-6H,1-2H3/b5-3-,6-4- APPOKADJQUIAHP-GLIMQPGKSA-N C/C=C\C=C/C   2,4-Hexadiene, (Z,Z)-; (Z),(Z)-2,4-Hexadiene; (Z),(Z)-CH3CH=CHCH=CHCH3; cis,cis-2,4-Hexadiene; (2Z,4Z)-hexa-2,4-diene
928494 C6H10 3-Hexyne InChI=1S/C6H10/c1-3-5-6-4-2/h3-4H2,1-2H3 DQQNMIPXXNPGCV-UHFFFAOYSA-N CCC#CCC   3-Hexyne; Diethylacetylene; Hex-3-yne
917920 C6H10 1-Butyne, 3,3-dimethyl- InChI=1S/C6H10/c1-5-6(2,3)4/h1H,2-4H3 PPWNCLVNXGCGAF-UHFFFAOYSA-N C#CC(C)(C)C   1-Butyne, 3,3-dimethyl-; 3,3,3-Trimethylpropyne; 3,3-Dimethyl-1-Butyne; 3,3-Dimethylbutyne; 3,3-Dimethylbutyne-1; t-Butylacetylene; tert-Butylacetylene; 3,3-dimethylbut-1-yne
764352 C6H10 2-Hexyne InChI=1S/C6H10/c1-3-5-6-4-2/h3,5H2,1-2H3 MELUCTCJOARQQG-UHFFFAOYSA-N CC#CCCC   1-Methyl-2-propylacetylene; 2-Hexyne; Hex-2-yne; Methyl(propyl)acetylene
1120623 C6H10 Cyclopentene, 3-methyl- InChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3 CXOZQHPXKPDQGT-UHFFFAOYSA-N C[C@@H]1C=CCC1   3-Methylcyclopentene; Cyclopentene, 3-methyl-; 3-methylcyclopent-1-ene
1759815 C6H10 Cyclopentene, 4-methyl- InChI=1S/C6H10/c1-6-4-2-3-5-6/h2-3,6H,4-5H2,1H3 FWMRUAODTCVEQK-UHFFFAOYSA-N CC1CC=CC1   1-Methyl-3-cyclopentene; 4-Methylcyclopentene; Cyclopentene, 4-methyl-; 4-methylcyclopent-1-ene
7318674 C6H10 1,4-Hexadiene, (Z)- InChI=1S/C6H10/c1-3-5-6-4-2/h3-4,6H,1,5H2,2H3/b6-4- PRBHEGAFLDMLAL-XQRVVYSFSA-N C=CC/C=C\C   1,4-Hexadiene, (Z)-; (Z)-CH2=CHCH2CH=CHCH3; cis-1,4-Hexadiene; (Z)-hexa-1,4-diene
7319008 C6H10 1,4-Hexadiene, (E)- InChI=1S/C6H10/c1-3-5-6-4-2/h3-4,6H,1,5H2,2H3/b6-4+ PRBHEGAFLDMLAL-GQCTYLIASA-N C=CC/C=C/C   1,4-Hexadiene, (E)-; (E)-CH2=CHCH2CH=CHCH3; trans-1,4-Hexadiene; (E)-hexa-1,4-diene
693890 C6H10 Cyclopentene, 1-methyl- InChI=1S/C6H10/c1-6-4-2-3-5-6/h4H,2-3,5H2,1H3 ATQUFXWBVZUTKO-UHFFFAOYSA-N CC1=CCCC1   1-Methyl-1-cyclopentane; 1-Methyl-1-cyclopentene; 1-Methylcyclopentene; Cyc1opentene,l-methyl-; Cyclopentene, 1-methyl-; 1-methylcyclopent-1-ene
693027 C6H10 1-Hexyne InChI=1S/C6H10/c1-3-5-6-4-2/h1H,4-6H2,2H3 CGHIBGNXEGJPQZ-UHFFFAOYSA-N C#CCCCC   1-Hexyne; Butylacetylene; Hex-1-yne; n-Butylacetylene
592427 C6H10 1,5-Hexadiene InChI=1S/C6H10/c1-3-5-6-4-2/h3-4H,1-2,5-6H2 PYGSKMBEVAICCR-UHFFFAOYSA-N C=CCCC=C   1,5-Hexadiene; α,ω-Hexadiene; Biallyl; Diallyl; Hexa-1,5-diene; Hexadiene; alpha,omega;+B52-Hexadiene+B10
110838 C6H10 cyclohexene InChI=1S/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2 HGCIXCUEYOPUTN-UHFFFAOYSA-N C1=CCCCC1   Benzene tetrahydride; Cyclohex-1-ene; UN 2256; Cykloheksen; Benzene, tetrahydro-; 1,2,3,4-Tetrahydrobenzene; 1-Cyclohexene; Tetrahydrobenzene; Hexanaphthylene; cyclohexene
20237347 C6H10 1,3-Hexadiene, (E)- InChI=1S/C6H10/c1-3-5-6-4-2/h3,5-6H,1,4H2,2H3/b6-5+ AHAREKHAZNPPMI-AATRIKPKSA-N C=C/C=C/CC   1,3-Hexadiene, (E)-; (E)-1,3-Hexadiene; (E)-CH2=CHCH=CHC2H5; (E)-hexa-1,3-diene
14596920 C6H10 1,3-Hexadiene, (Z)- InChI=1S/C6H10/c1-3-5-6-4-2/h3,5-6H,1,4H2,2H3/b6-5- AHAREKHAZNPPMI-WAYWQWQTSA-N C=C/C=C\CC   1,3-Hexadiene, (Z)-; Z-1,3-Hexadiene; (Z)-hexa-1,3-diene
15679013 C6H12 cis-1,2-dimethylcyclobutane InChI=1S/C6H12/c1-5-3-4-6(5)2/h5-6H,3-4H2,1-2H3/t5-,6+ IVAGOJQDJFWIRT-OLQVQODUSA-N C[C@H]1[C@@H](C)CC1   (1R,2S)-1,2-dimethylcyclobutane
15679013 C6H12 cis-1,2-dimethylcyclobutane InChI=1S/C6H12/c1-5-3-4-6(5)2/h5-6H,3-4H2,1-2H3/t5-,6+ IVAGOJQDJFWIRT-OLQVQODUSA-N C[C@H]1[C@@H](C)CC1   (1R,2S)-1,2-dimethylcyclobutane
15679024 C6H12 (1R,2R)-1,2-dimethylcyclobutane InChI=1S/C6H12/c1-5-3-4-6(5)2/h5-6H,3-4H2,1-2H3/t5-,6-/m1/s1 IVAGOJQDJFWIRT-PHDIDXHHSA-N C[C@H]1[C@H](C)CC1   trans-1,2-dimethylcyclobutane; (1R,2R)-1,2-dimethylcyclobutane
18931710 C4H6(CH3)2 dimethylcyclobutane InChI=1S/C6H12/c1-6(2)4-3-5-6/h3-5H2,1-2H3 OFZYBEBWCZBCPM-UHFFFAOYSA-N CC1(C)CCC1   Cyclobutane, 1,1-dimethyl-; 1,1-dimethylcyclobutane
18931710 C4H6(CH3)2 dimethylcyclobutane InChI=1S/C6H12/c1-6(2)4-3-5-6/h3-5H2,1-2H3 OFZYBEBWCZBCPM-UHFFFAOYSA-N CC1(C)CCC1   Cyclobutane, 1,1-dimethyl-; 1,1-dimethylcyclobutane
13269528 C6H12 (E)-hex-3-ene InChI=1S/C6H12/c1-3-5-6-4-2/h5-6H,3-4H2,1-2H3/b6-5+ ZQDPJFUHLCOCRG-AATRIKPKSA-N CC/C=C/CC   3-Hexene, (E)-; (E)-3-Hexene; trans-3-Hexene; (E)-3-C6H12; trans-hex-3-ene
110827 C6H12 Cyclohexane InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2 XDTMQSROBMDMFD-UHFFFAOYSA-N C1CCCCC1   Benzene, hexahydro-; Cicloesano; Cyclohexane; Cykloheksan; Hexahydrobenzene; Hexamethylene; Hexanaphthene; Rcra waste number U056; UN 1145
110827 C6H12 Cyclohexane InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2 XDTMQSROBMDMFD-UHFFFAOYSA-N C1CCCCC1   Benzene, hexahydro-; Cicloesano; Cyclohexane; Cykloheksan; Hexahydrobenzene; Hexamethylene; Hexanaphthene; Rcra waste number U056; UN 1145
592416 C6H12 hex-1-ene InChI=1S/C6H12/c1-3-5-6-4-2/h3H,1,4-6H2,2H3 LIKMAJRDDDTEIG-UHFFFAOYSA-N C=CCCCC   1-n-Hexene; 1-C6H12; 1-Hexene; Butylethylene; Hex-1-ene; Hexene; Hexene-1; UN 2370
563780 C6H12 2,3-dimethylbut-1-ene InChI=1S/C6H12/c1-5(2)6(3)4/h6H,1H2,2-4H3 OWWIWYDDISJUMY-UHFFFAOYSA-N C=C(C)C(C)C   1-Butene, 2,3-dimethyl-; 2,3-Dimethyl-1-butene; 2,3-Dimethylbutene-1; Tetramethylethylene; 2,3-dimethylbut-1-ene
563791 C6H12 2,3-dimethyl-but-2-ene InChI=1S/C6H12/c1-5(2)6(3)4/h1-4H3 WGLLSSPDPJPLOR-UHFFFAOYSA-N CC(C)=C(C)C   1,1,2,2-Tetramethylethylene; 2,3-Dimethyl-2-butene; 2,3-Dimethylbut-2-ene; 2,3-Dimethylbutene-2; 2-Butene, 2,3-dimethyl-; Tetramethylethene; Tetramethylethylene
616126 C6H12 (E)-3-methylpent-2-ene InChI=1S/C6H12/c1-4-6(3)5-2/h4H,5H2,1-3H3/b6-4+ BEQGRRJLJLVQAQ-GQCTYLIASA-N C/C=C(C)/CC   (E)-3-Methyl-2-pentene; (E)-CH3CH=C(CH3)C2H5; 2-Pentene, 3-methyl-, (E)-; 3-Methyl-trans-2-pentene; trans-3-Methyl-2-Pentene; (E)-3-methylpent-2-ene
96377 C6H12 Cyclopentane, methyl- InChI=1S/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H3 GDOPTJXRTPNYNR-UHFFFAOYSA-N CC1CCCC1   Cyclopentane, methyl-; Methylcyclopentane; UN 2298
7642093 C6H12 (Z)-hex-3-ene InChI=1S/C6H12/c1-3-5-6-4-2/h5-6H,3-4H2,1-2H3/b6-5- ZQDPJFUHLCOCRG-WAYWQWQTSA-N CC/C=C\CC   cis-3-Hexene; z-hex-3-ene
7688213 C6H12 (Z)-hex-2-ene InChI=1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3- RYPKRALMXUUNKS-HYXAFXHYSA-N C/C=C\CCC   cis-2-Hexene; (Z)-2-Hexene; 2-Hexene, cis-; (Z)-hex-2-ene; cis-hex-2-ene
7688213 C6H12 (Z)-hex-2-ene InChI=1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3- RYPKRALMXUUNKS-HYXAFXHYSA-N C/C=C\CCC   cis-2-Hexene; (Z)-2-Hexene; 2-Hexene, cis-; (Z)-hex-2-ene; cis-hex-2-ene
760214 C6H12 3-methylenepentane InChI=1S/C6H12/c1-4-6(3)5-2/h3-5H2,1-2H3 RYKZRKKEYSRDNF-UHFFFAOYSA-N CCC(CC)=C   1,1-Diethylethene; 1-Butene, 2-ethyl-; 2-Ethyl-1-butene; 3-Methylenepentane; Pentane, 3-methylene-
922623 C6H12 (Z)-3-methylpent-2-ene InChI=1S/C6H12/c1-4-6(3)5-2/h4H,5H2,1-3H3/b6-4- BEQGRRJLJLVQAQ-XQRVVYSFSA-N C/C=C(C)\CC   (Z)-3-Methyl-2-pentene; (Z)-CH3CH=C(CH3)C2H5; 2-Pentene, 3-methyl-, (Z)-; 3-Methyl-cis-2-pentene; cis-3-Methyl-2-pentene; (Z)-3-methylpent-2-ene
4806615 C6H12 Ethylcyclobutane InChI=1S/C6H12/c1-2-6-4-3-5-6/h6H,2-5H2,1H3 NEZRFXZYPAIZAD-UHFFFAOYSA-N CCC1CCC1   Cyclobutane, ethyl-; Ethylcyclobutane
4050457 C6H12 (E)-2-Hexene InChI=1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+ RYPKRALMXUUNKS-HWKANZROSA-N C/C=C/CCC   (E)-2-Hexene; trans-2-Hexene; (E)-2-C6H12; trans-hex-2-ene; (E)-hex-2-ene
4050457 C6H12 (E)-2-Hexene InChI=1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+ RYPKRALMXUUNKS-HWKANZROSA-N C/C=C/CCC   (E)-2-Hexene; trans-2-Hexene; (E)-2-C6H12; trans-hex-2-ene; (E)-hex-2-ene
2398096 C6H12 cis-1,3-dimethylcyclobutane InChI=1S/C6H12/c1-5-3-6(2)4-5/h5-6H,3-4H2,1-2H3/t5-,6+ WKHRDGKOKYBNDZ-OLQVQODUSA-N C[C@@H]1C[C@H](C)C1   (1s,3s)-1,3-dimethylcyclobutane
2398109 C6H12 (1r,3r)-1,3-dimethylcyclobutane InChI=1S/C6H12/c1-5-3-6(2)4-5/h5-6H,3-4H2,1-2H3/t5-,6- WKHRDGKOKYBNDZ-IZLXSQMJSA-N C[C@@H]1C[C@@H](C)C1   (1r,3r)-1,3-dimethylcyclobutane
2398109 C6H12 (1r,3r)-1,3-dimethylcyclobutane InChI=1S/C6H12/c1-5-3-6(2)4-5/h5-6H,3-4H2,1-2H3/t5-,6- WKHRDGKOKYBNDZ-IZLXSQMJSA-N C[C@@H]1C[C@@H](C)C1   (1r,3r)-1,3-dimethylcyclobutane
79298 C6H14 Butane, 2,3-dimethyl- InChI=1S/C6H14/c1-5(2)6(3)4/h5-6H,1-4H3 ZFFMLCVRJBZUDZ-UHFFFAOYSA-N CC(C)C(C)C   2,3-Dimethylbutane; Biisopropyl; Butane, 2,3-dimethyl-; Diisopropyl; UN 2457
96140 C6H14 Pentane, 3-methyl- InChI=1S/C6H14/c1-4-6(3)5-2/h6H,4-5H2,1-3H3 PFEOZHBOMNWTJB-UHFFFAOYSA-N CCC(C)CC   3-Methylpentane; Pentane, 3-methyl-; UN 1208; UN 2462
75832 C6H14 Butane, 2,2-dimethyl- InChI=1S/C6H14/c1-5-6(2,3)4/h5H2,1-4H3 HNRMPXKDFBEGFZ-UHFFFAOYSA-N CC(C)(C)CC   2,2-Dimethylbutane; Butane, 2,2-dimethyl-; Neohexane; UN 1208
107835 C6H14 Pentane, 2-methyl- InChI=1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3 AFABGHUZZDYHJO-UHFFFAOYSA-N CC(C)CCC   2-Methylpentane; Isohexane; Methyl pentane; Pentane, 2-methyl-; UN 1208; UN 2462
110543 C6H14 Hexane InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3 VLKZOEOYAKHREP-UHFFFAOYSA-N CCCCCC   Esani; Gettysolve-B; Heksan; Hexane; Hexanen; Hexyl hydride; n-C6H14; NCI-C60571; n-Hexane; Skellysolve B; UN 1208
497201 C6H6 Fulvene InChI=1S/C6H6/c1-6-4-2-3-5-6/h2-5H,1H2 PGTKVMVZBBZCKQ-UHFFFAOYSA-N C=C1C=CC=C1   1,3-Cyclopentadiene, 5-methylene-; Fulvene
285585 C6H10 Bicyclo[3.1.0]hexane InChI=1S/C6H10/c1-2-5-4-6(5)3-1/h5-6H,1-4H2 JAPMJSVZDUYFKL-UHFFFAOYSA-N [C@@H]12CCC[C@@H]1C2   Bicyclo[3.1.0]hexane; Norsabinane; Northujane
1071983 C4N2 2-Butynedinitrile InChI=1S/C4N2/c5-3-1-2-4-6 ZEHZNAXXOOYTJM-UHFFFAOYSA-N N#CC#CC#N   1,2-Dicyanoacetylene; 2-Butynedinitrile; Acetylenedicarbonitrile; Dicyanoacetylene; Dicyanoethyne; NCC#CCN; Sous-azote de carbone; but-2-ynedinitrile
764421 C4H2N2 Fumaronitrile InChI=1S/C4H2N2/c5-3-1-2-4-6/h1-2H/b2-1+ KYPOHTVBFVELTG-OWOJBTEDSA-N N#C/C=C/C#N   2-Butenedinitrile, (E)-; (E)-Butenedinitrile; (E)-CH(CN)CH(CN); Fumaric Nitrile; Fumarodinitrile; Fumaronitrile; Furmaronitrile; trans-1,2-Dicyanoethylene
290960 C2H2N4 sym-tetrazine InChI=1S/C2H2N4/c1-3-5-2-6-4-1/h1-2H HTJMXYRLEDBSLT-UHFFFAOYSA-N C1=NN=CN=N1   1,2,4,5-Tetrazine; s-Tetrazine
290879 C3H3N3 1,3,5-Triazine InChI=1S/C3H3N3/c1-4-2-6-3-5-1/h1-3H JIHQDMXYYFUGFV-UHFFFAOYSA-N N1=CN=CN=C1   1,3,5-Triazine; Cyanidine; s-Triazine; s-Triazine-(1,3,5); sym-Triazine; Vedita 250
4418615 CH3N5 5-Aminotetrazole InChI=1S/CH3N5/c2-1-3-5-6-4-1/h(H3,2,3,4,5,6) ULRPISSMEBPJLN-UHFFFAOYSA-N NC1=NN=NN1   1H-Tetrazol-5-amine; 1H-Tetrazole, 5-amino-; 5-Amino-1,2,3,4-tetrazole; 5-Amino-1H-tetrazole; 5-Aminotetrazole; Aminotetrazole
4076362 C2H4N4 1H-Tetrazole, 5-methyl- InChI=1S/C2H4N4/c1-2-3-5-6-4-2/h1H3,(H,3,4,5,6) XZGLNCKSNVGDNX-UHFFFAOYSA-N CC1=NN=NN1   1H-Tetrazole, 5-methyl-; 5-Methyltetrazole; 5-methyl-1H-tetrazole
289805 C4H4N2 Pyridazine InChI=1S/C4H4N2/c1-2-4-6-5-3-1/h1-4H PBMFSQRYOILNGV-UHFFFAOYSA-N C1=NN=CC=C1   1,2-Diazabenzene; 1,2-Diazine; Orthodiazine; Pyridazine
289952 C4H4N2 1,3-Diazine InChI=1S/C4H4N2/c1-2-5-4-6-3-1/h1-4H CZPWVGJYEJSRLH-UHFFFAOYSA-N N1=CC=CN=C1   1,3-Diazabenzene; 1,3-Diazine; m-Diazine; Metadiazine; Miazine; Pyrimidine
290379 C4H4N2 Pyrazine InChI=1S/C4H4N2/c1-2-6-4-3-5-1/h1-4H KYQCOXFCLRTKLS-UHFFFAOYSA-N C1=NC=CN=C1   1,4-Diazabenzene; 1,4-Diazine; Paradiazine; p-Diazine; Piazine; Pyrazine
110612 C4H4N2 Succinonitrile InChI=1S/C4H4N2/c5-3-1-2-4-6/h1-2H2 IAHFWCOBPZCAEA-UHFFFAOYSA-N N#CCCC#N   1,4-Butanedinitrile; 1,2-Dicyanoethane; Butanedinitrile; Deprelin; Dician; Dinile; Disuxyl; Ethane, 1,2-dicyano-; Ethylene cyanide; Ethylene dicyanide; Evanex; NCCH2CH2CN; s-Dicyanoethane; Succinic acid dinitrile; Succinic acid nitrile; Succinic dinitrile; Succinil; Succinodinitrile; Succinonitrile; Sukcinonitril; Suxil; sym-Dicyanoethane; USAF a-9442
16681779 C2H4N4 1H-Tetrazole, 1-methyl- InChI=1S/C2H4N4/c1-6-2-3-4-5-6/h2H,1H3 OMAFFHIGWTVZOH-UHFFFAOYSA-N CN1N=NN=C1   1-Methyl-1H-tetrazole; 1-Methyltetrazole; 1H-Tetrazole, 1-methyl-; N-Methyltetrazole
16681780 C2H4N4 2H-Tetrazole, 2-methyl- InChI=1S/C2H4N4/c1-6-4-2-3-5-6/h2H,1H3 VRESBNUEIKZECD-UHFFFAOYSA-N CN1N=CN=N1   2H-Tetrazole, 2-methyl-; 2-Methyltetrazole; 2-methyl-2H-tetrazole
16955354 C5H5N Bicyclo[1.1.0]butane-1-carbonitrile InChI=1S/C5H5N/c6-3-5-1-4(5)2-5/h4H,1-2H2 BPPMXXJOMACYJD-UHFFFAOYSA-N N#C[C@@]12C[C@@H]1C2   1-Cyanobicyclo[1.1.0]butane; Bicyclo[1.1.0]butane-1-carbonitrile
110861 C5H5N Pyridine InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H JUJWROOIHBZHMG-UHFFFAOYSA-N C1=NC=CC=C1   Azabenzene; Azine; NCI-C55301; Piridina; Pirydyna; Pyridin; Pyridine; Rcra waste number U196; UN 1282; py
6569513 B3N3H6 borazine InChI=1S/B3H6N3/c1-4-2-6-3-5-1/h1-6H BGECDVWSWDRFSP-UHFFFAOYSA-N B1NBNBN1   s-Triazaborane; s-Triazatriborine, hexahydro-; Borazole; Borazyne, cyclic trimer; Triborinetriamine; 1,3,5,2,4,6-Triazatriborine, hexahydro-; 1,3,5,2,4,6-triazatriborinane
693981 C4H6N2 1H-Imidazole, 2-methyl- InChI=1S/C4H6N2/c1-4-5-2-3-6-4/h2-3H,1H3,(H,5,6) LXBGSDVWAMZHDD-UHFFFAOYSA-N CC1=NC=CN1   1H-Imidazole, 2-methyl-; 2-Methylimidazole; Imidazole, 2-methyl-; 2-methyl-1H-imidazole
16969452 C5H6N+ Pyridinium InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H/p+1 JUJWROOIHBZHMG-UHFFFAOYSA-O [NH+]1=CC=CC=C1   pyridin-1-ium; Pyridine, conjugate acid
16529661 C5H7N (E)-3-Pentenenitrile InChI=1S/C5H7N/c1-2-3-4-5-6/h2-3H,4H2,1H3/b3-2+ UVKXJAUUKPDDNW-NSCUHMNNSA-N C/C=C/CC#N   (E)-3-Pentenenitrile; (E)-pent-3-enenitrile
26294984 C5H7N (E)-2-Pentenenitrile InChI=1S/C5H7N/c1-2-3-4-5-6/h3-4H,2H2,1H3/b4-3+ ISBHMJZRKAFTGE-ONEGZZNKSA-N CC/C=C/C#N   (E)-2-Pentenenitrile; 2-Pentenenitrile, (E)-; (E)-pent-2-enenitrile
25899507 C5H7N (Z)-2-Pentenenitrile InChI=1S/C5H7N/c1-2-3-4-5-6/h3-4H,2H2,1H3/b4-3- ISBHMJZRKAFTGE-ARJAWSKDSA-N CC/C=C\C#N   (Z)-2-Pentenenitrile; 2-Pentenenitrile, (Z)-; (Z)-pent-3-enenitrile
4426113 C5H7N Cyclobutanecarbonitrile InChI=1S/C5H7N/c6-4-5-2-1-3-5/h5H,1-3H2 GFBLFDSCAKHHGX-UHFFFAOYSA-N N#CC1CCC1   Cyanocyclobutane; Cyclobutanecarbonitrile; Cyclobutyl cyanide
96548 C5H7N 1H-Pyrrole, 1-methyl- InChI=1S/C5H7N/c1-6-4-2-3-5-6/h2-5H,1H3 OXHNLMTVIGZXSG-UHFFFAOYSA-N CN1C=CC=C1   1-Methyl-1H-pyrrole; 1-Methylpyrrole; 1H-Pyrrole, 1-methyl-; N-Methylpyrrol; N-Methylpyrrole; Pyrrole, 1-methyl-
110598 C5H9N Pentanenitrile InChI=1S/C5H9N/c1-2-3-4-5-6/h2-4H2,1H3 RFFFKMOABOFIDF-UHFFFAOYSA-N CCCCC#N   1-Butyl cyanide; 1-Cyanobutane; Butane, 1-cyano-; Butyl cyanide; n-Valeronitrile; Pentanenitrile; Pentanonitrile; Valeronitrile
630182 C5H9N Propanenitrile, 2,2-dimethyl- InChI=1S/C5H9N/c1-5(2,3)4-6/h1-3H3 JAMNHZBIQDNHMM-UHFFFAOYSA-N CC(C)(C)C#N   2,2-Dimethylpropanenitrile; 2,2-Dimethylpropionitrile; 2-Cyano-2-methylpropane; Pivalonitrile; Propanenitrile, 2,2-dimethyl-; tert-Butylcyanide; tert-Butylnitrile; Trimethylacetonitrile
694053 C5H9N 1,2,3,6-Tetrahydropyridine InChI=1S/C5H9N/c1-2-4-6-5-3-1/h1-2,6H,3-5H2 FTAHXMZRJCZXDL-UHFFFAOYSA-N C1CC=CCN1   δ(sup 3)-Piperidine; δ3-Piperidine; 1,2,3,6-Tetrahydropyridine; 1,2,5,6-Tetrahydropyridine; Pyridine, 1,2,3,6-tetrahydro-; UN 2410; delta3-Piperidine; delta3-Piperidine
18936179 C5H9N Butanenitrile, 2-methyl- InChI=1S/C5H9N/c1-3-5(2)4-6/h5H,3H2,1-2H3 RCEJCSULJQNRQQ-UHFFFAOYSA-N CC[C@@H](C)C#N   2-Methylbutanenitrile; 2-Methylbutyronitrile; 2-Cyanobutane; Butanenitrile, 2-methyl-; Butyronitrile, 2-methyl-
1003038 C5H11N Cyclopentanamine InChI=1S/C5H11N/c6-5-3-1-2-4-5/h5H,1-4,6H2 NISGSNTVMOOSJQ-UHFFFAOYSA-N NC1CCCC1   Amino cyclopentane; Cyclopentanamine; Cyclopentylamine
110894 C5H11N Piperidine InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2 NQRYJNQNLNOLGT-UHFFFAOYSA-N N1CCCCC1   Azacyclohexane; Cyclopentimine; Cypentil; Hexahydropyridine; Hexazane; Pentamethyleneimine; Pentamethylenimine; Perhydropyridine; Piperidin; Piperidine; Pyridine, hexahydro-; UN 2401
110894 C5H11N Piperidine InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2 NQRYJNQNLNOLGT-UHFFFAOYSA-N N1CCCCC1   Azacyclohexane; Cyclopentimine; Cypentil; Hexahydropyridine; Hexazane; Pentamethyleneimine; Pentamethylenimine; Perhydropyridine; Piperidin; Piperidine; Pyridine, hexahydro-; UN 2401
811938 C4H12N2 2-Methyl-1,2-propanediamine InChI=1S/C4H12N2/c1-4(2,6)3-5/h3,5-6H2,1-2H3 OPCJOXGBLDJWRM-UHFFFAOYSA-N CC(N)(C)CN   1,2-Diamino-2-methylpropane; 1,2-Propanediamine, 2-methyl-; 2-Methyl-1,2-propanediamine; Methyl-2 propanediamine-1,2; 2-methylpropane-1,2-diamine
4426486 C4H12N2 1,2-Butanediamine InChI=1S/C4H12N2/c1-2-4(6)3-5/h4H,2-3,5-6H2,1H3 ULEAQRIQMIQDPJ-UHFFFAOYSA-N CC[C@@H](N)CN   1,2-Butanediamine; butane-1,2-diamine
9000208 C2O4-- oxalate anion InChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)/p-2 MUBZPKHOEPUJKR-UHFFFAOYSA-L O=C([O-])C([O-])=O  
9000208 C2O4-- oxalate anion InChI=1/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)/p-2/fC2O4/q-2 MUBZPKHOEPUJKR-IRFIXJCZNA-L  
9000208 C2O4-- oxalate anion InChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)/p-2 MUBZPKHOEPUJKR-UHFFFAOYSA-L O=C([O-])C([O-])=O  
10544726 N2O4 Dinitrogen tetroxide InChI=1S/N2O4/c3-1(4)2(5)6 WFPZPJSADLPSON-UHFFFAOYSA-N O=N(N(=O)=O)=O   Dinitrogen tetraoxide; Dinitrogen tetroxide; NA 1067; Nitrogen dioxide, di-; Nitrogen oxide; Nitrogen oxide (N2O4); Nitrogen peroxide; Nitrogen tetroxide; UN 1067
144627 C2H2O4 Oxalic Acid InChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6) MUBZPKHOEPUJKR-UHFFFAOYSA-N OC(C(O)=O)=O   Ethanedioic acid; Oxiric acid; Acide oxalique; Acido ossalico; NCI-C55209; Ethane-1,2-dioic acid; oxalic acid
471476 C2H3NO3 Oxamic acid InChI=1S/C2H3NO3/c3-1(4)2(5)6/h(H2,3,4)(H,5,6) SOWBFZRMHSNYGE-UHFFFAOYSA-N NC(C(O)=O)=O   Acetic acid, aminooxo-; Formic acid, (aminocarbonyl)-; Formic acid, carbamoyl-; Glycine, 2-oxo-; Glyoxylic acid, amino-; OA; Oxalamic acid; Oxalic acid monoamide; Oxamate; Oxamate, (aminocarbonyl)-; Oxamic acid; Oxamidic acid; 2-amino-2-oxoacetic acid
471476 C2H3NO3 Oxamic acid InChI=1S/C2H3NO3/c3-1(4)2(5)6/h(H2,3,4)(H,5,6) SOWBFZRMHSNYGE-UHFFFAOYSA-N NC(C(O)=O)=O   Acetic acid, aminooxo-; Formic acid, (aminocarbonyl)-; Formic acid, carbamoyl-; Glycine, 2-oxo-; Glyoxylic acid, amino-; OA; Oxalamic acid; Oxalic acid monoamide; Oxamate; Oxamate, (aminocarbonyl)-; Oxamic acid; Oxamidic acid; 2-amino-2-oxoacetic acid
471465 C2H4N2O2 Oxalamide InChI=1S/C2H4N2O2/c3-1(5)2(4)6/h(H2,3,5)(H2,4,6) YIKSCQDJHCMVMK-UHFFFAOYSA-N O=C(N)C(N)=O   Amid kyseliny stavelove; Ethanediamide; Formimidic acid, 1-carbamoyl-; Oxalamide; Oxalic acid diamide; Oxamid; Oxamide; Oxamimidic acid
96491 C2H4CO3 Ethylene carbonate InChI=1S/C3H4O3/c4-3-5-1-2-6-3/h1-2H2 KMTRUDSVKNLOMY-UHFFFAOYSA-N O=C1OCCO1   1,3-Dioxolan-2-one; 1,3-Dioxacyclopentan-2-one
96491 C2H4CO3 Ethylene carbonate InChI=1S/C3H4O3/c4-3-5-1-2-6-3/h1-2H2 KMTRUDSVKNLOMY-UHFFFAOYSA-N O=C1OCCO1   1,3-Dioxolan-2-one; 1,3-Dioxacyclopentan-2-one
674828 C4H4O2 2-Oxetanone, 4-methylene- InChI=1S/C4H4O2/c1-3-2-4(5)6-3/h1-2H2 WASQWSOJHCZDFK-UHFFFAOYSA-N O=C(C1)OC1=C   2-Oxetanone, 4-methylene-; 3-Butenoic acid, 3-hydroxy-, β-lactone; 4-Methylene-2-oxetanone; Diketen; Diketene; Ethenone, dimer; Ketene dimer; Vinylaceto-β-lactone; 4-methyleneoxetan-2-one
5765446 C4H5NO Isoxazole, 5-methyl- InChI=1S/C4H5NO/c1-4-2-3-5-6-4/h2-3H,1H3 AGQOIYCTCOEHGR-UHFFFAOYSA-N CC1=CC=NO1   5-Methylisoxazole; Isoxazole, 5-methyl-; NSC 52269
625581 C2H5NO3 Nitric acid, ethyl ester InChI=1S/C2H5NO3/c1-2-6-3(4)5/h2H2,1H3 IDNUEBSJWINEMI-UHFFFAOYSA-N O=[N+]([O-])OCC   Ethyl nitrate; Ethylester kyseliny dusicne; NA 1993; Nitric acid, ethyl ester; Nitric ether
30842901 C4H5NO 3-Methylisoxazole InChI=1S/C4H5NO/c1-4-2-3-6-5-4/h2-3H,1H3 CUMCMYMKECWGHO-UHFFFAOYSA-N CC1=NOC=C1   3-Methylisoxazole; Isoxazole, 3-methyl-
37765154 C2H6N2O2 (E)-Azodioxymethane InChI=1S/C2H6N2O2/c1-3(5)4(2)6/h1-2H3/b4-3+ JFRQLMYPEFSEDK-ONEGZZNKSA-N CN(=N(C)=O)=O   (E)-(CH3NO)2; Diazene, dimethyl-, 1,2-dioxide, (E)-; (E)-1,2-dimethyldiazene 1,2-dioxide
37765154 C2H6N2O2 (E)-Azodioxymethane InChI=1S/C2H6N2O2/c1-3(5)4(2)6/h1-2H3/b4-3+ JFRQLMYPEFSEDK-ONEGZZNKSA-N CN(=N(C)=O)=O   (E)-(CH3NO)2; Diazene, dimethyl-, 1,2-dioxide, (E)-; (E)-1,2-dimethyldiazene 1,2-dioxide
534225 C5H6O 2-methylfuran InChI=1S/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H3 VQKFNUFAXTZWDK-UHFFFAOYSA-N CC1=[CH]=[CH]=CO1  
534225 C5H6O 2-methylfuran InChI=1S/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H3 VQKFNUFAXTZWDK-UHFFFAOYSA-N CC1=[CH]=[CH]=CO1  
110883 C3H6O3 1,3,5-Trioxane InChI=1S/C3H6O3/c1-4-2-6-3-5-1/h1-3H2 BGJSXRVXTHVRSN-UHFFFAOYSA-N O1COCOC1   1,3,5-Trioxacyclohexane; 1,3,5-Trioxan; 1,3,5-Trioxane; Aldeform; Formagene; Formaldehyde, trimer; Marvosan; Metaformaldehyde; Paraform; Paraformal; Paraformaldehyde; Polymerized formaldehyde; Polyoxymethylene; s-Trioxan; s-Trioxane; s-Trixane; sym-Trioxane; Trioxan; Triformol; Trioxymethylen; Trioxymethyleen; Trioxymethylene; Trioxane; Triossimetilene; Trioxin
431038 C4H6O2 2,3-Butanedione InChI=1S/C4H6O2/c1-3(5)4(2)6/h1-2H3 QSJXEFYPDANLFS-UHFFFAOYSA-N CC(C(C)=O)=O   2,3-Butadione; 2,3-Butanedione; 2,3-Diketobutane; 2,3-Dioxobutane; Biacetyl; Butadione; Butane-2,3-dione; Butanedione; Diacetyl; Dimethyl diketone; Dimethyl glyoxal; Glyoxal, dimethyl-; UN 2346
431038 C4H6O2 2,3-Butanedione InChI=1S/C4H6O2/c1-3(5)4(2)6/h1-2H3 QSJXEFYPDANLFS-UHFFFAOYSA-N CC(C(C)=O)=O   2,3-Butadione; 2,3-Butanedione; 2,3-Diketobutane; 2,3-Dioxobutane; Biacetyl; Butadione; Butane-2,3-dione; Butanedione; Diacetyl; Dimethyl diketone; Dimethyl glyoxal; Glyoxal, dimethyl-; UN 2346
96333 C4H6O2 2-Propenoic acid, methyl ester InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3 BAPJBEWLBFYGME-UHFFFAOYSA-N C=CC(OC)=O   2-Propenoic acid, methyl ester; Acrylate de methyle; Acrylic acid methyl ester; Acrylsaeuremethylester; Curithane 103; Methoxycarbonylethylene; Methyl 2-propenoate; Methyl acrylate; Methyl acrylate, inhibited; Methyl ester of 2-propenoic acid; Methyl prop-2-enoate; Methyl propenate; Methyl propenoate; Methylacrylaat; Methyl-acrylat; Methylester kyseliny akrylove; Metilacrilato; UN 1919
96480 C4H6O2 γ–Butyrolactone InChI=1S/C4H6O2/c5-4-2-1-3-6-4/h1-3H2 YEJRWHAVMIAJKC-UHFFFAOYSA-N O=C1OCCC1   1,4-Butanolide; 1,4-Butyrolactone; 1-Oxacyclopentan-2-one; 2(3H)-Furanone, dihydro-; α-Butyrolactone; γ-6480; γ-BL; γ-Butanolactone; γ-Butyrolactone; γ-Hydroxybutyric Acid cyclic ester; γ-Hydroxybutyric acid lactone; γ-Hydroxybutyrolactone; 1,2-Butanolide; 6480; 2-Oxolanone; 2-Oxotetrahydrofuran; 4-Butanolide; 4-Butyrolactone; 4-Deoxytetronic acid; 4-Hydroxybutanoic acid lactone; 4-Hydroxybutanoic acid, γ-lactone; 4-Hydroxybutyric acid lactone; 4-Hydroxybutyric acid, γ-lactone; BLO; BLON; Butanoic acid, 4-hydroxy-, γ-lactone; Butyric acid lactone; Butyric acid, 4-hydroxy-, γ-lactone; Butyrolactone; Butyryl lactone; Butyrylactone; Dehydro-2(3H)-furanone; Dihydro-2(3H)-furanone; Dihydro-2-furanone; NCI-C55878; Tetrahydro-2-furanone; alpha-Butyrolactone; gamma-6480; gamma-BL; gamma-Butanolactone; gamma-Butyrolactone; gamma-Hydroxybutyric Acid cyclic ester; gamma-Hydroxybutyric acid lactone; gamma-Hydroxybutyrolactone; dihydrofuran-2(3H)-one
107937 C4H6O2 Crotonic Acid InChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)/b3-2+ LDHQCZJRKDOVOX-NSCUHMNNSA-N C/C=C/C(O)=O   2-Butenoic acid, (E)-; (E)-Crotonic acid; (E)-2-Butenoic acid; trans-Crotonic Acid; trans-2-Butenoic Acid; a-butenoic acid, trans; -methylacrylic acid, trans; 3-Methylacrylic acid, trans
4164287 C2H6N2O2 Dimethylnitroamine InChI=1S/C2H6N2O2/c1-3(2)4(5)6/h1-2H3 XRWKADIRZXTTLH-UHFFFAOYSA-N O=[N+]([O-])N(C)C   Dimethylamine, N-nitro-; Dimethylnitramin; Dimethylnitramine; Methanamine, N-methyl-N-nitro-; Dmnm; DMNO; Methanamine, N-methyl-N-nitro-; N,N-Dimethylnitramine; N-Nitrodimethylamine; N-Nitro-dma; s-N,N-Dimethyl nitramine; N,N-dimethylnitramide
930278 C5H6O 3-Methylfuran InChI=1S/C5H6O/c1-5-2-3-6-4-5/h2-4H,1H3 KJRRQXYWFQKJIP-UHFFFAOYSA-N CC1=COC=C1   Furan, 3-methyl-
1120645 C4H7NO Oxazole, 4,5-dihydro-2-methyl- InChI=1S/C4H7NO/c1-4-5-2-3-6-4/h2-3H2,1H3 GUXJXWKCUUWCLX-UHFFFAOYSA-N CC1=NCCO1   2-Methyl-2-oxazoline; 2-Methyloxazoline; 2-Oxazoline, 2-methyl-; Oxazole, 4,5-dihydro-2-methyl-; 2-methyl-4,5-dihydrooxazole
107959 NH2CH2CH2COOH β–alanine InChI=1S/C3H7NO2/c4-2-1-3(5)6/h1-2,4H2,(H,5,6) UCMIRNVEIXFBKS-UHFFFAOYSA-N OC(CCN)=O   β-Alanine; β-Aminopropionic acid; ω-Aminopropionic acid; 3-Aminopropanoic acid; 3-Aminopropionic acid; Abufene; ALANINE, β; b-Alanine; Propanoic acid, 3-amino-; beta-Alanine; beta-Aminopropionic acid; omega-Aminopropionic acid
107971 CH3NHCH2COOH Sarcosine InChI=1S/C3H7NO2/c1-4-2-3(5)6/h4H,2H2,1H3,(H,5,6) FSYKKLYZXJSNPZ-UHFFFAOYSA-N CNCC(O)=O   (Methylamino)ethanoic acid; Acetic acid, (methylamino)-; Glycine, N-methyl-; Methylaminoacetic acid; Methylglycine; N-Methylaminoacetic acid; N-Methylglycine; Sarcosin; Sarcosine; Sarcosinic acid; 2-(methylamino)acetic acid
79390 C4H7NO Methacrylamide InChI=1S/C4H7NO/c1-3(2)4(5)6/h1H2,2H3,(H2,5,6) FQPSGWSUVKBHSU-UHFFFAOYSA-N CC(C(N)=O)=C   α-Methyl acrylic amide; 2-Methylacrylamide; 2-Methylpropenamide; 2-Propenamide, 2-methyl-; Amid kyseliny methakrylove; Methacryamide; Methacrylamide; Methacrylic acid amide; Methacrylic amide; Methylacrylic amide; Mhoromer bm801; USAF rh-1; alpha-Methyl acrylic amide
51796 NH2COOC2H5 Urethane InChI=1S/C3H7NO2/c1-2-6-3(4)5/h2H2,1H3,(H2,4,5) JOYRKODLDBILNP-UHFFFAOYSA-N CCOC(N)=O   A 11032; Aethylcarbamat; Aethylurethan; Carbamic acid, ethyl ester; Carbamidsaeure-aethylester; Estane 5703; Ethyl carbamate; Ethyl ester of carbamic acid; Ethyl urethan; Ethyl urethane; Ethylester kyseliny karbaminove; Leucethane; Leucothane; NSC 746; O-Ethylurethane; Pracarbamin; Pracarbamine; Rcra waste number U238; U-Compound; Uretan; Urethane; X 41; Uretan etylowy; Urethan
135 HCONH2CN2H4 formamide aminomethanimine dimer InChI=1S/C2H7N3O/c1-3-7-5-2-6-8-4-1/h1-5H/b3-1- QJIDZIDMDYHMLH-IWQZZHSRSA-N NC=N.NC=O  
56417 CH3CH(NH2)COOH Alanine InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1 QNAYBMKLOCPYGJ-UWTATZPHSA-N CC(N)C(O)=O   α-Alanine; α-Aminopropionic acid; (S)-2-Aminopropanoic acid; (S)-Alanine; Alanine; Alanine, L-; L-(+)-Alanine; L-α-Alanine; L-α-Aminopropionic acid; L-2-Aminopropanoic acid; L-2-Aminopropionic acid; L-Alanine; L-CH3CH(NH2)COOH; Propanoic acid, 2-amino-; Propanoic acid, 2-amino-, (S)-; Ala; alpha-Alanine; alpha-Aminopropionic acid; 2-aminopropanoic acid
56417 CH3CH(NH2)COOH Alanine InChI=1/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1/f/h5H QNAYBMKLOCPYGJ-FIXCMCSDNA-N CC(N)C(O)=O   α-Alanine; α-Aminopropionic acid; (S)-2-Aminopropanoic acid; (S)-Alanine; Alanine; Alanine, L-; L-(+)-Alanine; L-α-Alanine; L-α-Aminopropionic acid; L-2-Aminopropanoic acid; L-2-Aminopropionic acid; L-Alanine; L-CH3CH(NH2)COOH; Propanoic acid, 2-amino-; Propanoic acid, 2-amino-, (S)-; Ala; alpha-Alanine; alpha-Aminopropionic acid; 2-aminopropanoic acid
543679 C3H7ONO Propyl nitrite InChI=1S/C3H7NO2/c1-2-3-6-4-5/h2-3H2,1H3 KAOQVXHBVNKNHA-UHFFFAOYSA-N O=NOCCC   n-C3H7ONO; Nitrous acid, n-propyl ester; Nitrous acid, propyl ester; n-Propyl nitrite; Propanol nitrite; Propyl nitrite
543679 C3H7ONO Propyl nitrite InChI=1S/C3H7NO2/c1-2-3-6-4-5/h2-3H2,1H3 KAOQVXHBVNKNHA-UHFFFAOYSA-N O=NOCCC   n-C3H7ONO; Nitrous acid, n-propyl ester; Nitrous acid, propyl ester; n-Propyl nitrite; Propanol nitrite; Propyl nitrite
541424 CH3CH(CH3)ONO Iso-propyl nitrite InChI=1S/C3H7NO2/c1-3(2)6-4-5/h3H,1-2H3 SKRDXYBATCVEMS-UHFFFAOYSA-N O=NOC(C)C   2-Propanol nitrite; i-C3H7ONO; iso-Propyl nitrite; Isopropylester kyseliny dusite; Nitrous acid, 1-methylethyl ester; Nitrous acid, isopropyl ester; isopropyl nitrite
616455 C4H7NO 2-Pyrrolidinone InChI=1S/C4H7NO/c6-4-2-1-3-5-4/h1-3H2,(H,5,6) HNJBEVLQSNELDL-UHFFFAOYSA-N O=C1NCCC1   α-Pyrrolidinone; α-Pyrrolidone; γ-aminobutyric acid lactam; γ-Aminobutyric lactam; γ-Aminobutyrolactam; γ-Butyrolactam; 2-Oxopyrrolidine; 2-Oxypyrrolidine; 2-Pyrol; 2-Pyrol4-aminobutyric acid lactam; 2-Pyrrolidine; 2-Pyrrolidinone; 2-Pyrrolidone; 4-Aminobutyric acid lactam; Butanoic acid, 4-amino-; Butanoic acid, 4-amino-, lactam; Butyrolactam; Lactam; LAM; Pyrrolidon; Pyrrolidone; alpha-Pyrrolidinone; alpha-Pyrrolidone; gamma-aminobutyric acid lactam; gamma-Aminobutyric lactam; gamma-Aminobutyrolactam; gamma-Butyrolactam; pyrrolidin-2-one
62957602 C4H7NO Ethoxyacetonitrile InChI=1S/C4H7NO/c1-2-6-4-3-5/h2,4H2,1H3 WPYUCWSMVJJWFI-UHFFFAOYSA-N N#CCOCC   2-ethoxyacetonitrile
598947 N(CH3)2CONH2 Urea, N,N-dimethyl- InChI=1S/C3H8N2O/c1-5(2)3(4)6/h1-2H3,(H2,4,6) YBBLOADPFWKNGS-UHFFFAOYSA-N O=C(N)N(C)C   1,1-Dimethylurea; 1,1-Dimethyurea; Asym-Dimethylurea; N,N-Dimethylurea; Urea, 1,1-dimethyl-; Urea, N,N-dimethyl-
625525 NH2CONHC2H5 Urea, ethyl- InChI=1S/C3H8N2O/c1-2-5-3(4)6/h2H2,1H3,(H3,4,5,6) RYECOJGRJDOGPP-UHFFFAOYSA-N O=C(N)NCC   1-Ethylurea; Ethylurea; N-Ethylurea; Urea, 1-ethyl-; Urea, ethyl-
497267 C4H8O2 1,3-Dioxolane, 2-methyl- InChI=1S/C4H8O2/c1-4-5-2-3-6-4/h4H,2-3H2,1H3 HTWIZMNMTWYQRN-UHFFFAOYSA-N CC1OCCO1   1,3-Dioxolane, 2-methyl-; 2-Methyl-1,3-dioxacyclopentane; 2-Methyl-1,3-dioxolane; 2-Methyldioxolane; 2-Methyldioxole; Methyldioxolane
505226 C4H8O2 1,3-Dioxane InChI=1S/C4H8O2/c1-2-5-4-6-3-1/h1-4H2 VDFVNEFVBPFDSB-UHFFFAOYSA-N O1COCCC1   1,3-Dioxacyclohexane; 1,3-Dioxane; 1,3-Propanediol formal; m-Dioxane; m-Dioxin, dihydro-
505226 C4H8O2 1,3-Dioxane InChI=1S/C4H8O2/c1-2-5-4-6-3-1/h1-4H2 VDFVNEFVBPFDSB-UHFFFAOYSA-N O1COCCC1   1,3-Dioxacyclohexane; 1,3-Dioxane; 1,3-Propanediol formal; m-Dioxane; m-Dioxin, dihydro-
123911 C4H8O2 1,4-Dioxane InChI=1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2 RYHBNJHYFVUHQT-UHFFFAOYSA-N O1CCOCC1   1,4-Diethylene dioxide; 1,4-Dioxacyclohexane; 1,4-Dioxan; 1,4-Dioxane; 1,4-Dioxin, tetrahydro-; Di(ethylene oxide); Diethylene dioxide; Diethylene ether; Diokan; Dioksan; Diossano-1,4; Dioxaan-1,4; Dioxan; Dioxan-1,4; Dioxane; Dioxane-1,4; Dioxanne; Dioxyethylene ether; Glycol ethylene ether; NCI-C03689; p-Dioxan; p-Dioxane; p-Dioxin, tetrahydro-; Rcra waste number U108; Tetrahydro-1,4-dioxin; Tetrahydro-p-dioxin; UN 1165; 1,4Dioxane
120923 C5H8O Cyclopentanone InChI=1S/C5H8O/c6-5-3-1-2-4-5/h1-4H2 BGTOWKSIORTVQH-UHFFFAOYSA-N O=C1CCCC1   Adipic ketone; Adipinketon; Cyclopentanone; Dumasin; Ketocyclopentane; Ketopentamethylene; UN 2245
110872 C5H8O 2H-Pyran, 3,4-dihydro- InChI=1S/C5H8O/c1-2-4-6-5-3-1/h2,4H,1,3,5H2 BUDQDWGNQVEFAC-UHFFFAOYSA-N C1CCC=CO1   2,3-Dihydro-4H-pyran; δ(Sup2)-Dihydropyran; δ2-Dihydropyran; 2H-3,4-Dihydropyran; 2H-Pyran, 3,4-dihydro-; 2,3-Dihydropyran; 3,4-Dihdro-2H-pyrane; 3,4-Dihydro-1H-pyran; 3,4-Dihydro-2H-pyran; 3,4-Dihydro-2-pyran; 3,4-Dihydropyran; 5,6-Dihydro-4H-pyran; Dihydropyran; Pyran, dihydro-; delta 2-Dihydropyran; delta2-Dihydropyran
141786 C4H8O2 Ethyl acetate InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3 XEKOWRVHYACXOJ-UHFFFAOYSA-N CC(OCC)=O   Acetic acid, ethyl ester; Acetic ester; Acetic ether; Acetidin; Acetoxyethane; Aethylacetat; Essigester; Ethyl Acetate; Ethyl acetic ester; Ethyl ester of acetic acid; Ethyl ethanoate; Ethylacetaat; Ethyle; Ethyle(acetate d'); Ethylester kyseliny octove; Etile; Etile(acetato di); Octan etylu; Rcra waste number U112; UN 1173; Vinegar naphtha
141786 C4H8O2 Ethyl acetate InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3 XEKOWRVHYACXOJ-UHFFFAOYSA-N CC(OCC)=O   Acetic acid, ethyl ester; Acetic ester; Acetic ether; Acetidin; Acetoxyethane; Aethylacetat; Essigester; Ethyl Acetate; Ethyl acetic ester; Ethyl ester of acetic acid; Ethyl ethanoate; Ethylacetaat; Ethyle; Ethyle(acetate d'); Ethylester kyseliny octove; Etile; Etile(acetato di); Octan etylu; Rcra waste number U112; UN 1173; Vinegar naphtha
56815 C3H8O3 1,2,3-Propanetriol InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2 PEDCQBHIVMGVHV-UHFFFAOYSA-N OCC(O)CO   1,2,3-Propanetriol; 1,2,3-Trihydroxypropane; 90 Technical glycerin; 90 Technical glycerine; Clyzerin, wasserfrei; Dagralax; Glycerin; Glycerin, anhydrous; Glycerin, synthetic; Glycerine; Glyceritol; Glycerol; Glycyl alcohol; Glyrol; Glysanin; Grocolene; Moon; Ophthalgan; Optim; Osmoglyn; Propanetriol; Star; Superol; Synthetic glycerin; Synthetic glycerine; Vitrosupos; Trihydroxypropane; propane-1,2,3-triol
96311 NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- InChI=1S/C3H8N2O/c1-4-3(6)5-2/h1-2H3,(H2,4,5,6) MGJKQDOBUOMPEZ-UHFFFAOYSA-N O=C(NC)NC   1,3-Dimethylurea; 1,1'-Dimethylurea; DMU; N,N'-Dimethylharnstoff; N,N'-Dimethylurea; sym-Dimethylurea; Symmetric dimethylurea; Urea, N,N'-dimethyl-; Urea, 1,3-dimethyl-
922690 C4H8O2 Ethene, 1,1-dimethoxy- InChI=1S/C4H8O2/c1-4(5-2)6-3/h1H2,2-3H3 FJTRNRFAIZEJJJ-UHFFFAOYSA-N C=C(OC)OC   Ethene, 1,1-dimethoxy-; 1,1-dimethoxyethene
765435 C5H8O Methyl cyclopropyl ketone InChI=1S/C5H8O/c1-4(6)5-2-3-5/h5H,2-3H2,1H3 HVCFCNAITDHQFX-UHFFFAOYSA-N O=C(C)C1CC1   1-Cyclopropylethanone; Acetylcyclopropane; Cyclopropyl methyl ketone; Cyclopropylethanone; Ethanone, 1-cyclopropyl-; Ketone, cyclopropyl methyl; Methyl cyclopropyl ketone
1487156 C5H8O Furan, 2,3-dihydro-5-methyl- InChI=1S/C5H8O/c1-5-3-2-4-6-5/h3H,2,4H2,1H3 BGCWDXXJMUHZHE-UHFFFAOYSA-N CC1=CCCO1   2-Methyl-4,5-dihydrofuran; 2,3-Dihydro-5-methylfuran; 4,5-Dihydro-2-methylfuran; 4,5-Dihydrosylvan; 5-Methyl-2,3-dihydrofuran; Furan, 2,3-dihydro-5-methyl-
541355 C4H9NO Butanamide InChI=1S/C4H9NO/c1-2-3-4(5)6/h2-3H2,1H3,(H2,5,6) DNSISZSEWVHGLH-UHFFFAOYSA-N CCCC(N)=O   Butanamide; Butanimidic acid; Butyramide; n-Butylamide; n-Butyramide; n-C3H7C(O)NH2
563837 C4H9NO Propanamide, 2-methyl- InChI=1S/C4H9NO/c1-3(2)4(5)6/h3H,1-2H3,(H2,5,6) WFKAJVHLWXSISD-UHFFFAOYSA-N CC(C)C(N)=O   2-Methylpropanamide; 2-Methylpropionamide; Isobutylamide; Isobutyramide; Isobutyrimidic acid; Isopropylformamide; Propanamide, 2-methyl-
563804 C5H10O 2-Butanone, 3-methyl- InChI=1S/C5H10O/c1-4(2)5(3)6/h4H,1-3H3 SYBYTAAJFKOIEJ-UHFFFAOYSA-N CC(C(C)C)=O   2-Acetylpropane; 2-Butanone, 3-methyl-; 3-Methyl-2-butanone; 3-Methylbutan-2-one; iso-C3H7COCH3; Isopropyl methyl ketone; Ketone, isopropyl methyl; Methyl butanone-2; Methyl isopropyl ketone; Methyl propyl ketone; Methylbutanone; Mipk; UN 2397
534156 C4H10O2 1,1-Dimethoxyethane InChI=1S/C4H10O2/c1-4(5-2)6-3/h4H,1-3H3 SPEUIVXLLWOEMJ-UHFFFAOYSA-N CC(OC)OC   1,1-Dimethoxyethane; 1,1'-Dimethoxyetiane; Acetaldehyde, dimethyl acetal; Dimethyl acetal; Dimethyl aldehyde; Ethane, 1,1-dimethoxy-; Ethylidene dimethyl ether; Methyl formyl; UN 2377
142687 C5H10O 2H-Pyran, tetrahydro- InChI=1S/C5H10O/c1-2-4-6-5-3-1/h1-5H2 DHXVGJBLRPWPCS-UHFFFAOYSA-N C1CCCCO1   2H-Pyran, tetrahydro-; Oxacyclohexane; Oxane; Pentamethylene oxide; Tetrahydro-2H-pyran; Tetrahydropyran; THP
110623 C5H10O Pentanal InChI=1S/C5H10O/c1-2-3-4-5-6/h5H,2-4H2,1H3 HGBOYTHUEUWSSQ-UHFFFAOYSA-N CCCCC=O   Valeraldehyde; n-Pentanal; n-Valeraldehyde; Valeral; Valerianic aldehyde; Valeric acid aldehyde; Valeric aldehyde; Valeryl aldehyde; Amyl aldehyde; Butyl formal; UN 2058; n-Valeric aldehyde; 1-pentanal; pentan-1-al; pentanal
110634 C4H10O2 1,4-Butanediol InChI=1S/C4H10O2/c5-3-1-2-4-6/h5-6H,1-4H2 WERYXYBDKMZEQL-UHFFFAOYSA-N OCCCCO   1,4-BD; 1,4-Butanediol; 1,4-Butylene glycol; 1,4-Dihydroxybutane; 1,4-Tetramethylene glycol; Butane-1,4-diol; Butanediol; Diol 14B; Sucol B; Tetramethylene 1,4-diol; Tetramethylene glycol
110714 C4H10O2 Ethane, 1,2-dimethoxy- InChI=1S/C4H10O2/c1-5-3-4-6-2/h3-4H2,1-2H3 XTHFKEDIFFGKHM-UHFFFAOYSA-N COCCOC   α,β-Dimethoxyethane; 1,2-Dimethoxyethane; 1,2-Ethanediol dimethyl ether; 2,5-Dioxahexane; Dimethoxyethane; Dimethyl cellosolve; Dimethyl cellosolve monoglyme; Egdme; Ethane, 1,2-dimethoxy-; Ethylene dimethyl ether; Ethylene glycol dimethyl ether; Glycol dimethyl ether; Glyme; Monoethylene glycol dimethyl ether; Monoglyme; UN 2252; alpha,beta-Dimethoxyethane
96220 C5H10O 3-Pentanone InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3 FDPIMTJIUBPUKL-UHFFFAOYSA-N CCC(CC)=O   3-Pentanone; DEK; Diethyl ketone; Diethylcetone; Dimethylacetone; Ethyl Ketone; Ethyl propionyl; Metacetone; Methacetone; Pentan-3-one; Pentanone-3; Propione; UN 1156
96413 C5H10O Cyclopentanol InChI=1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2 XCIXKGXIYUWCLL-UHFFFAOYSA-N OC1CCCC1   Cyclopentanol; Cyclopentyl alcohol; Hydroxycyclopentane; UN 2244
96173 C5H10O 2-methylbutyraldehyde InChI=1S/C5H10O/c1-3-5(2)4-6/h4-5H,3H2,1-2H3/t5-/m1/s1 BYGQBDHUGHBGMD-RXMQYKEDSA-N CC[C@@H](C)C=O   Butanal, 2-methyl-; a-Methylbutanal; a-Methylbutyraldehyde; Methylethylacetaldehyde; 2-Formylbutane; 2-Methylbutanal; 2-Methylbutyraldehyde; Acetaldehyde, ethylmethyl-
107879 C5H10O 2-Pentanone InChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3 XNLICIUVMPYHGG-UHFFFAOYSA-N CC(CCC)=O   2-Pentanone; Ethyl acetone; Methyl n-propyl ketone; Methyl propyl ketone; Metylopropyloketon; MPK; n-C3H7COCH3; Pentan-2-one; Propyl methyl ketone; UN 1249; pentan-2-one
107879 C5H10O 2-Pentanone InChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3 XNLICIUVMPYHGG-UHFFFAOYSA-N CC(CCC)=O   2-Pentanone; Ethyl acetone; Methyl n-propyl ketone; Methyl propyl ketone; Metylopropyloketon; MPK; n-C3H7COCH3; Pentan-2-one; Propyl methyl ketone; UN 1249; pentan-2-one
107880 C4H10O2 1,3-Butanediol InChI=1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3 PUPZLCDOIYMWBV-UHFFFAOYSA-N C[C@@H](O)CCO   1,3-Butandiol; 1,3-Butanediol; 1,3-Butylene glycol; 1,3-Butylenglykol; 1,3-Dihydroxybutane; 1-Methyl-1,3-propanediol; β-Butylene glycol; Butane-1,3-diol; Methyltrimethylene glycol; beta-Butylene glycol
6921353 C5H10O Oxetane, 3,3-dimethyl- InChI=1S/C5H10O/c1-5(2)3-6-4-5/h3-4H2,1-2H3 RVGLUKRYMXEQAH-UHFFFAOYSA-N CC1(C)COC1   1,3-Epoxy-2,2-dimethylpropane; β,β-Dimethyltrimethylene oxide; 3,3-Dimethyloxetane; 3,3-Dimethyltrimethylene oxide; Oxetane, 3,3-dimethyl-; Propane, 1,3-epoxy-2,2-dimethyl-; beta,beta-Dimethyltrimethylene oxide
3710847 C4H11NO Diethylhydroxylamine InChI=1S/C4H11NO/c1-3-5(6)4-2/h6H,3-4H2,1-2H3 FVCOIAYSJZGECG-UHFFFAOYSA-N ON(CC)CC   DEHA; Diethylhydroxylamine; Ethanamine, N-ethyl-N-hydroxy-; Hydroxylamine, N,N-diethyl-; N,N-Diethylhydroxyamine; N,N-Diethylhydroxylamine; N-Hydroxydiethylamine
6032297 C5H12O 2-Pentanol InChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3 JYVLIDXNZAXMDK-UHFFFAOYSA-N C[C@H](O)CCC   1-Methyl-1-Butanol; 1-Methylbutanol; 2-Pentanol; 2-Pentyl alcohol; Isoamyl alcohol, secondary; Methylpropylcarbinol; n-C3H7CH(OH)CH3; Pentan-2-ol; Pentanol-2; sec-Amyl Alcohol; sec-n-Amyl alcohol; sec-Pentanol; sec-Pentyl alcohol; UN 1105
1634044 C5H12O Propane, 2-methoxy-2-methyl- InChI=1S/C5H12O/c1-5(2,3)6-4/h1-4H3 BZLVMXJERCGZMT-UHFFFAOYSA-N CC(C)(OC)C   2-Methoxy-2-methylpropane; 2-Methyl-2-methoxypropane; Ether, tert-butyl methyl; Methyl 1,1-dimethylethyl ether; Methyl t-butyl ether; Methyl tert-butyl ether; MTBE; Propane, 2-methoxy-2-methyl-; tert-Butyl methyl ether; tert-C4H9OCH3; UN 2398; ether
71410 C5H12O 1-Pentanol InChI=1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3 AMQJEAYHLZJPGS-UHFFFAOYSA-N CCCCCO   1-Pentanol; 1-Pentyl alcohol; Alcool amylique; Amyl alcohol; Amyl alcohol, n-; Amyl alcohol, normal; Amylol; n-Amyl alcohol; n-Amylalkohol; n-Butylcarbinol; n-C5H11OH; n-Pentan-1-ol; n-Pentanol; n-Pentyl alcohol; Pentan-1-ol; Pentanol; Pentanol-1; Pentasol; Pentyl alcohol; Primary amyl alcohol; UN 1105
123513 C5H12O 1-Butanol, 3-methyl- InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3 PHTQWCKDNZKARW-UHFFFAOYSA-N CC(C)CCO   1-Butanol, 3-methyl-; 2-Methyl-4-butanol; 3-Methyl-1-butanol; 3-Methylbutan-1-ol; 3-Methylbutanol; 3-Metil-butanolo; Alcool amilico; Alcool isoamylique; Amylowy alkohol; Fermentation amyl alcohol; Fusel Oil; Fuseloel; Huile de fusel; Isoamyl alcohol; Isoamyl alcohol, primary; iso-amylalkohol; Isoamylol; Isobutyl carbinol; Isopentanol; Isopentyl alcohol; UN 1105
137326 C5H12O 1-Butanol, 2-methyl- InChI=1S/C5H12O/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3 QPRQEDXDYOZYLA-UHFFFAOYSA-N CC[C@@H](C)CO   1-Butanol, 2-methyl-; 2-Methyl butanol-1; 2-Methyl-1-butanol; 2-Methylbutanol; 2-Methylbutyl alcohol; 2-Methyl-n-butanol; Active Amyl alcohol; Active primary amyl alcohol; Amyl alcohol; dl-2-Methyl-1-butanol; dl-sec-Butyl carbinol; L-2-Methyl-1-butanol; Primary active amyl alcohol; sec-Butylcarbinol; 2-methylbutan-1-ol
584021 C5H12O 3-Pentanol InChI=1S/C5H12O/c1-3-5(6)4-2/h5-6H,3-4H2,1-2H3 AQIXEPGDORPWBJ-UHFFFAOYSA-N CCC(O)CC   Diethyl carbinol; 3-Pentyl alcohol; Pentan-3-ol; sec-Amyl alcohol; Pentanol-3; UN 2706
598754 C5H12O 2-Butanol, 3-methyl- InChI=1S/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3 MXLMTQWGSQIYOW-UHFFFAOYSA-N C[C@H](O)C(C)C   2-Butanol, 3-methyl-; (+)-3-Methyl-2-butanol; 3-Methyl-2-butanol; Butan-2-ol, 3-methyl-; Methylisopropylcarbinol; sec-Isoamyl Alcohol; 3-methylbutan-2-ol
628320 C5H12O Propane, 1-ethoxy- InChI=1S/C5H12O/c1-3-5-6-4-2/h3-5H2,1-2H3 NVJUHMXYKCUMQA-UHFFFAOYSA-N CCCOCC   1-Ethoxypropane; Ether, ethyl propyl; Ethyl n-propyl ether; Ethyl propyl ether; n-C3H7OC2H5; Propane, 1-ethoxy-; Propyl ethyl ether; UN 2615; ether
628284 C5H12O Butane, 1-methoxy- InChI=1S/C5H12O/c1-3-4-5-6-2/h3-5H2,1-2H3 CXBDYQVECUFKRK-UHFFFAOYSA-N CCCCOC   1-Methoxybutane; α-Methoxybutane; Butane, 1-methoxy-; Butyl methyl ether; Ether, butyl methyl; Methyl butyl ether; Methyl n-butyl ether; n-Butyl methyl ether; n-C4H9OCH3; UN 2350; ether; alpha-Methoxybutane
116143 C2F4 Tetrafluoroethylene InChI=1S/C2F4/c3-1(4)2(5)6 BFKJFAAPBSQJPD-UHFFFAOYSA-N FC(F)=C(F)F   1,1,2,2-Tetrafluoroethylene; Ethene, tetrafluoro-; Ethylene, tetrafluoro-; Fluoroplast 4; Perfluoroethene; Perfluoroethylene; Tetrafluorethylene; Tetrafluoroethene; Ethane, tetrafluoro-; Tetrafluoroethylene, inhibited; TFE; UN 1081
116143 C2F4+ Tetrafluoroethylene cation InChI=1S/C2HF4/c3-1(4)2(5)6/h1H/q+1 GMSBBTQGWZXBDQ-UHFFFAOYSA-N F[C](F)[C+](F)F  
373911 CF3OF Trifluoromethylhypofluorite InChI=1S/CF4O/c2-1(3,4)6-5 SMBZJSVIKJMSFP-UHFFFAOYSA-N FOC(F)(F)F   Hypofluorous acid, trifluoromethyl ester; perfluoromethanol; trifluoromethyl hypofluorite
353855 CF3CN Acetonitrile, trifluoro- InChI=1S/C2F3N/c3-2(4,5)1-6 SFFUEHODRAXXIA-UHFFFAOYSA-N N#CC(F)(F)F   Acetonitrile, trifluoro-; Cyanotrifluoromethane; Trifluoroacetonitrile; 2,2,2-trifluoroacetonitrile
353855 CF3CN+ Acetonitrile, trifluoro- cation InChI=1S/C2F3N/c3-2(4,5)1-6/q+1 SCBXZZKBQIAMHS-UHFFFAOYSA-N FC(F)([C+][N])F  
13965736 B2F4 Diboron tetrafluoride InChI=1S/B2F4/c3-1(4)2(5)6 WUWOPJNIAKTBSJ-UHFFFAOYSA-N FB(F)B(F)F   Diboron tetrafluoride; Difluoroborane; perfluorodiborane
13965736 B2F4 Diboron tetrafluoride InChI=1S/B2F4/c3-1(4)2(5)6 WUWOPJNIAKTBSJ-UHFFFAOYSA-N FB(F)B(F)F   Diboron tetrafluoride; Difluoroborane; perfluorodiborane
75901 CF3CHO trifluoroacetaldehyde InChI=1S/C2HF3O/c3-2(4,5)1-6/h1H JVTSHOJDBRTPHD-UHFFFAOYSA-N O=CC(F)(F)F  
76051 CF3COOH trifluoroacetic acid InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7) DTQVDTLACAAQTR-UHFFFAOYSA-N OC(C(F)(F)F)=O   Perfluoroacetic acid; Acetic acid, trifluoro-; Trifluoroethanoic acid; 2,2,2-Trifluoroacetic acid
359353 CHF2CHF2 1,1,2,2-tetrafluoroethane InChI=1S/C2H2F4/c3-1(4)2(5)6/h1-2H WXGNWUVNYMJENI-UHFFFAOYSA-N FC(F)C(F)F   Ethane, 1,1,2,2-tetrafluoro-; Freon 134; R 134
811972 CF3CH2F 1,1,1,2-tetrafluoroethane InChI=1S/C2H2F4/c3-1-2(4,5)6/h1H2 LVGUZGTVOIAKKC-UHFFFAOYSA-N FCC(F)(F)F  
9000444 Na2CO3 Sodium Carbonate InChI=1S/CH2O3.2Na/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2 CDBYLPFSWZWCQE-UHFFFAOYSA-L O=C([O-])[O-].[Na+].[Na+]  
7647190 PF5 Phosphorus pentafluoride InChI=1S/F5P/c1-6(2,3,4)5 OBCUTHMOOONNBS-UHFFFAOYSA-N FP(F)(F)(F)F   Phosphorane, pentafluoro-; Phosphorus fluoride; Phosphorus pentafluoride; Phosphorus(V) fluoride; UN 2198; pentafluorophosphorane; pentafluoro-λ5-phosphane
7285327 C3H4O2S 2H-Thiete-1,1-dioxide InChI=1S/C3H4O2S/c4-6(5)2-1-3-6/h1-2H,3H2 SYHFISYHXDUGDV-UHFFFAOYSA-N O=S1(CC=C1)=O   2H-Thiete-1,1-dioxide; Thiete 1,1-dioxide; Thiete sulfone
822388 C3H4S3 1,3-Dithiolane-2-thione InChI=1S/C3H4S3/c4-3-5-1-2-6-3/h1-2H2 XCWPBWWTGHQKDR-UHFFFAOYSA-N S=C1SCCS1   1,3-Dithiacyclopentane-2-thial; 1,3-Dithiolan-2-thione; 1,3-Dithiolane-2-thione; Carbonic acid, trithio-, cyclic ethylene ester; Cyclic ethylene trithiocarbonate; Cylic ethylene trithiocarbonate; Ethylene trithiocarbonate; Trithiocarbonic acid, cyclic ethylene ester
79403 C2H4N2S2 Ethanedithioamide InChI=1S/C2H4N2S2/c3-1(5)2(4)6/h(H2,3,5)(H2,4,6) OAEGRYMCJYIXQT-UHFFFAOYSA-N S=C(N)C(N)=S   Dithiooxamide; Dithioxamide; Ethanedithioamide; Hydrorubeanic acid; Oxaldiimidic acid, dithio-; Oxamide, dithio-; Rubean; Rubeane; Rubeanic acid; RVK; USAF B-43; USAF ek-4394; USAF mk-6; ethanebis(thioamide)
693958 C4H5NS 4-Methylthiazole InChI=1S/C4H5NS/c1-4-2-6-3-5-4/h2-3H,1H3 QMHIMXFNBOYPND-UHFFFAOYSA-N CC1=CSC=N1   4-Methylthiazole; Thiazole, 4-methyl-
616422 C2H6O3S Sulfurous acid, dimethyl ester InChI=1S/C2H6O3S/c1-4-6(3)5-2/h1-2H3 BDUPRNVPXOHWIL-UHFFFAOYSA-N O=S(OC)OC   Dimethoxy sulfoxide; Dimethyl ester of sulfurous acid; Dimethyl sulfite; Dimethyl sulphite; Methyl sulfite; Sulfurous acid, dimethyl ester; Sulphurous acid dimethyl ester
616444 C5H6S Thiophene, 3-methyl- InChI=1S/C5H6S/c1-5-2-3-6-4-5/h2-4H,1H3 QENGPZGAWFQWCZ-UHFFFAOYSA-N CC1=CSC=C1   3-Methylthiophene; 3-Thiotolene; Methyl-3-thiophene; Thiophene, 3-methyl-
554143 C5H6S Thiophene, 2-methyl- InChI=1S/C5H6S/c1-5-3-2-4-6-5/h2-4H,1H3 XQQBUAPQHNYYRS-UHFFFAOYSA-N CC1=CC=CS1   2-Methylthiophene; Thiophene, 2-methyl-
1003049 C4H6OS Dihydro-3-(2H)-thiophenone InChI=1S/C4H6OS/c5-4-1-2-6-3-4/h1-3H2 DSXFPRKPFJRPIB-UHFFFAOYSA-N O=C1CSCC1   3(2H)-Thiophenone, dihydro-; 3-Oxo-2,3,4,5-tetrahydrothiophene; 3-Oxotetrahydrothiophene; 3-Thiacyclopentanone; 3-Thiophanone; 4,5-Dihydro-3(2H)-thiophenone; Dihydro-3-(2H)-thiophenone; Tetrahydrothiophen-3-one; Tetrahydrothiophene-3-one; dihydrothiophen-3(2H)-one
1003107 C4H6OS Dihydro-2-(3H)-thiophenone InChI=1S/C4H6OS/c5-4-2-1-3-6-4/h1-3H2 KMSNYNIWEORQDJ-UHFFFAOYSA-N O=C1CCCS1   2(3H)-Thiophenone, dihydro-; γ-Thiobutyrolactone; 2-Oxothiolane; 2-Thiophenone, tetrahydro-; 4,5-Dihydro-3(2H)-thiophenone; 4-Butyrothiolactone; 4-Thiobutyrolactone; Dihydro-2-(3H)-thiophenone; Tetrahydro-2-thiophenone; Thiacyclopentan-2-one; Thiacyclopentanone-2; Thiolan-2-one; gamma-Thiobutyrolactone; dihydrothiophen-2(3H)-one
1115157 C4H6OS Vinyl sulfoxide InChI=1S/C4H6OS/c1-3-6(5)4-2/h3-4H,1-2H2 HQSMEHLVLOGBCK-UHFFFAOYSA-N O=S(C=C)C=C   Divinyl sulfoxide; Ethene, 1,1-sulfinylbis-; TL 907; Vinyl sulfoxide; (vinylsulfinyl)ethene
2231574 CH6N4S Carbonothioic dihydrazide InChI=1S/CH6N4S/c2-4-1(6)5-3/h2-3H2,(H2,4,5,6) LJTFFORYSFGNCT-UHFFFAOYSA-N NNC(NN)=S   1,3-Diamino-2-Thiourea; Carbohydrazide, thio-; Carbonothioic dihydrazide; Hydrazinecarbohydrazonothioic acid; TCH; Thiocarbazide; Thiocarbohydrazide; Thiocarbonic dihydrazide; Thiocarbonohydrazide; USAF ek-7372; dihydrazinylmethanethial
2314489 C3H6S3 Carbonotrithioic acid, dimethyl ester InChI=1S/C3H6S3/c1-5-3(4)6-2/h1-2H3 IQWMXKTYXNMSLC-UHFFFAOYSA-N S=C(SC)SC   Carbonic acid, trithio-, dimethyl ester; Carbonotrithioic acid, dimethyl ester; Dimethyl trithiocarbonate; Dimethylester kyseliny trithiouhlicite; Trithiocarbonic acid dimethyl ester; dimethyl carbonotrithioate
9000082 C4H6OS 4,5-dihydrothiophene-3-ol InChI=1S/C4H6OS/c5-4-1-2-6-3-4/h3,5H,1-2H2 FJWGFFBQIDJMFZ-UHFFFAOYSA-N OC1=CSCC1   3-hydroxy,2,3-dihydrothiophene; 4,5-dihydrothiophen-3-ol
9000082 C4H6OS 4,5-dihydrothiophene-3-ol InChI=1/C4H6OS/c5-4-1-2-6-3-4/h3,5H,1-2H2 FJWGFFBQIDJMFZ-UHFFFAOYSA-N OC1=CSCC1   3-hydroxy,2,3-dihydrothiophene; 4,5-dihydrothiophen-3-ol
9000093 C4H6OS 2,5-dihydrothiophene-3-ol InChI=1S/C4H6OS/c5-4-1-2-6-3-4/h1,5H,2-3H2 ZAPZCYLRLRKDDD-UHFFFAOYSA-N OC1=CCSC1  
9000106 C4H6OS 4,5-dihydrothiophene-2-ol InChI=1S/C4H6OS/c5-4-2-1-3-6-4/h2,5H,1,3H2 LKCHSNFSFPARNH-UHFFFAOYSA-N OC1=CCCS1  
9000117 C4H6OS 2,3-dihydrothiophene-2-ol InChI=1S/C4H6OS/c5-4-2-1-3-6-4/h1,3-5H,2H2/t4-/m1/s1 FYXURNDAQXEZPB-SCSAIBSYSA-N O[C@@H]1CC=CS1  
9000117 C4H6OS 2,3-dihydrothiophene-2-ol InChI=1S/C4H6OS/c5-4-2-1-3-6-4/h1,3-5H,2H2 FYXURNDAQXEZPB-UHFFFAOYSA-N O[C@@H]1CC=CS1  
594434 C3H8O2S (Methylsulphonyl)ethane InChI=1S/C3H8O2S/c1-3-6(2,4)5/h3H2,1-2H3 YBJCDTIWNDBNTM-UHFFFAOYSA-N CCS(=O)(C)=O   (Methylsulphonyl)ethane; Ethyl methyl sulphone; Methyl ethyl sulfone; (methylsulfonyl)ethane
625605 C4H8OS s-Ethyl thioacetate InChI=1S/C4H8OS/c1-3-6-4(2)5/h3H2,1-2H3 APTGPWJUOYMUCE-UHFFFAOYSA-N CC(SCC)=O   Acetic acid, thio-, S-ethyl ester; Ethanethioic acid S-ethyl ester; Ethyl thioacetate; Ethyl thiolacetate; S-Ethyl ethanethioate; S-Ethyl thioacetate; S-Ethyl thiolacetate; Thioacetic acid, ethyl ester
70291 C4H10OS Diethyl sulfoxide InChI=1S/C4H10OS/c1-3-6(5)4-2/h3-4H2,1-2H3 CCAFPWNGIUBUSD-UHFFFAOYSA-N CC[S](=O)CC   1,1'-Sulphinylbisethane; Deso; Diaethylsulfoxid; Diethyl sulfoxide; Diethyl sulphoxide; Ethane, 1,1'-sulfinylbis-; Ethyl sulfoxide; (ethylsulfinyl)ethane
4740005 C5H10S Thiophene, tetrahydro-3-methyl- InChI=1S/C5H10S/c1-5-2-3-6-4-5/h5H,2-4H2,1H3 DLABLFPCTXRQMY-UHFFFAOYSA-N C[C@H]1CSCC1   3-Methyltetrahydrothiophene; 3-Methylthiacyclopentane; 3-Methylthiolane; Tetrahydro-3-methylthiophene; Thiophene, tetrahydro-3-methyl-
5296628 C5H10S 3-Ethylthio-1-propene InChI=1S/C5H10S/c1-3-5-6-4-2/h3H,1,4-5H2,2H3 NOJXPGXFDASWEI-UHFFFAOYSA-N C=CCSCC   3-Ethylthio-1-propene; Allyl ethyl sulfide; allyl(ethyl)sulfane
1679078 C5H10S Cyclopentanethiol InChI=1S/C5H10S/c6-5-3-1-2-4-5/h5-6H,1-4H2 WVDYBOADDMMFIY-UHFFFAOYSA-N SC1CCCC1   Cyclopentanethiol; Cyclopentyl mercaptan; Mercaptocyclopentane
1795091 C5H10S Thiophene, tetrahydro-2-methyl- InChI=1S/C5H10S/c1-5-3-2-4-6-5/h5H,2-4H2,1H3 AJPGNQYBSTXCJE-UHFFFAOYSA-N C[C@@H]1CCCS1   2-Methyltetrahydrothiophene; 2-Methylthiacyclopentane; 2-Methylthiolane; 2-Methylthiophane; 5-Methyltetrahydro-2-thenylamine; 5-Methyltetrahydro-2-thenylamined; Tetrahydro-2-methylthiophene; Thiophene, tetrahydro-2-methyl-
1613510 C5H10S 2H-Thiopyran, tetrahydro- InChI=1S/C5H10S/c1-2-4-6-5-3-1/h1-5H2 YPWFISCTZQNZAU-UHFFFAOYSA-N C1CCCCS1   2H-Thiopyran, tetrahydro-; Pentamethylene sulfide; Penthiophane; Tetrahydro-2H-thiopyran; Tetrahydrothiapyran; Tetrahydrothiopyran; Thiacyclohexane; Thiane
1191088 C4H10S2 1,4-Butanedithiol InChI=1S/C4H10S2/c5-3-1-2-4-6/h5-6H,1-4H2 SMTOKHQOVJRXLK-UHFFFAOYSA-N SCCCCS   1,4-Butanedithiol; 1,4-Dimercaptobutane; Tetramethylene dimercaptan; Tetramethylenedithiol; butane-1,4-dithiol
1878188 C5H12S 1-Butanethiol, 2-methyl- InChI=1S/C5H12S/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3 WGQKBCSACFQGQY-UHFFFAOYSA-N CC[C@@H](C)CS   1-Butanethiol, 2-methyl-; 2-Methyl-1-butanethiol; 2-methylbutane-1-thiol
1679089 C5H12S 1-Propanethiol, 2,2-dimethyl- InChI=1S/C5H12S/c1-5(2,3)4-6/h6H,4H2,1-3H3 LSUXMVNABVPWMF-UHFFFAOYSA-N CC(C)(C)CS   1-Propanethiol, 2,2-dimethyl-; 2,2-Dimethyl-1-propanethiol; Neopentyl mercaptan; 2,2-dimethylpropane-1-thiol
1679090 C5H12S 2-Butanethiol, 2-methyl- InChI=1S/C5H12S/c1-4-5(2,3)6/h6H,4H2,1-3H3 IQIBYAHJXQVQGB-UHFFFAOYSA-N CC(S)(C)CC   2-Methybutane-2-thiol; 2-Methyl-2-butanethiol; 2-Butanethiol, 2-methyl-; 2-tert-Pentyl mercaptan; tert-Amyl mercaptan; tert-Pentyl mercaptan
2084186 C5H12S 2-Butanethiol, 3-methyl- InChI=1S/C5H12S/c1-4(2)5(3)6/h4-6H,1-3H3 BFLXFRNPNMTTAA-UHFFFAOYSA-N C[C@H](S)C(C)C   2-Butanethiol, 3-methyl-; 3-Methyl-2-butanethiol; 3-methylbutane-2-thiol
5145993 C5H12S Propane, 2-(ethylthio)- InChI=1S/C5H12S/c1-4-6-5(2)3/h5H,4H2,1-3H3 NZUQQADVSXWVNW-UHFFFAOYSA-N CC(SCC)C   2-(Ethylthio)propane; 2-Methyl-3-thiapentane; Ethyl isopropyl sulfide; Isopropyl ethyl sulfide; Isopropyl ethyl sulphide; Propane, 2-(ethylthio)-; Sulfide, ethyl isopropyl; ethyl(isopropyl)sulfane
6163640 C5H12S Propane, 2-methyl-2-(methylthio)- InChI=1S/C5H12S/c1-5(2,3)6-4/h1-4H3 CJFVCTVYZFTORU-UHFFFAOYSA-N CC(SC)(C)C   2-Methyl-2-(methylthio)-propane; 3,3-Dimethyl-2-thiabutane; Methyl t-butyl sulfide; Methyl tert-butyl sulfide; Propane, 2-methyl-2-(methylthio)-; Sulfide, tert-butyl methyl; tert-Butyl Methyl sulfide; tert-Butyl methyl sulphide; tert-butyl(methyl)sulfane
4110503 C5H12S Ethyl propyl sulfide InChI=1S/C5H12S/c1-3-5-6-4-2/h3-5H2,1-2H3 ZDDDFDQTSXYYSE-UHFFFAOYSA-N CCCSCC   1-(Ethylthio)propane; 3-Thiahexane; Ethyl n-propyl sulfide; sulfide, ethyl propyl; Ethyl propyl sulphide; Ethyl propyl thio ether; n-C3H7SC2H5; Propane, 1-(ethylthio)-; Propyl ethyl sulfide; Sulfide, ethyl propyl; ethyl(propyl)sulfane
628295 C5H12S Butane, 1-(methylthio)- InChI=1S/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H3 WCXXISMIJBRDQK-UHFFFAOYSA-N CCCCSC   1-(Methylthio)butane; 2-Thiahexane; Butane, 1-(methylthio)-; Butyl methyl sulfide; Butyl methyl sulphide; Butyl methyl thioether; Methyl butyl sulfide; Methyl-n-butyl sulfide; Sulfide, butyl methyl; butyl(methyl)sulfane
541311 C5H12S 1-Butanethiol, 3-methyl- InChI=1S/C5H12S/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3 GIJGXNFNUUFEGH-UHFFFAOYSA-N CC(C)CCS   1-Butanethiol, 3-methyl-; 2-Methyl-4-butanethiol; 3-Methyl-1-butanethiol; 3-Methylbutanethiol; Isoamyl mercaptan; Isoamyl sulfhydrate; Isopentyl mercaptan; 3-methylbutane-1-thiol
110667 C5H12S 1-Pentanethiol InChI=1S/C5H12S/c1-2-3-4-5-6/h6H,2-5H2,1H3 ZRKMQKLGEQPLNS-UHFFFAOYSA-N CCCCCS   1-Mercaptopentane; 1-Pentanethiol; Amyl hydrosulfide; Amyl mercaptan; Amyl sulfhydrate; Amyl thioalcohol; Mercaptan amylique; n-Amyl mercaptan; n-Pentyl mercaptan; Pentalarm; Pentane-1-thiol; Pentanethiol; Pentyl mercaptan; UN 1111
10546017 SF5 Sulfur pentafluoride InChI=1S/F5S/c1-6(2,3,4)5 HAQZDUWRNKKMQY-UHFFFAOYSA-N F[S](F)(F)(F)F  
10546017 SF5 Sulfur pentafluoride InChI=1S/F5S/c1-6(2,3,4)5 HAQZDUWRNKKMQY-UHFFFAOYSA-N F[S](F)(F)(F)F  
10026138 PCl5 Phosphorus pentachloride InChI=1S/Cl5P/c1-6(2,3,4)5 UHZYTMXLRWXGPK-UHFFFAOYSA-N ClP(Cl)(Cl)(Cl)Cl   Fosforo(pentacloruro di); Fosforpentachloride; Phosphorane, pentachloro-; Phosphore(pentachlorure de); Phosphoric chloride; Phosphorous pentachloride; Phosphorpentachlorid; Phosphorus chloride; Phosphorus pentachloride; Phosphorus perchloride; Phosphorus(V) chloride; Pieciochlorek fosforu; UN 1806; pentachlorophosphorane; pentachloroλ5-phosphane
13637633 ClF5 chlorinepentafluoride InChI=1S/ClF5/c2-1(3,4,5)6 KNSWNNXPAWSACI-UHFFFAOYSA-N FCl(F)(F)(F)F   Chlorine fluoride; UN 2548; Chlorine pentafluoride
13637633 ClF5 chlorinepentafluoride InChI=1S/ClF5/c2-1(3,4,5)6 KNSWNNXPAWSACI-UHFFFAOYSA-N FCl(F)(F)(F)F   Chlorine fluoride; UN 2548; Chlorine pentafluoride
13701672 B2Cl4 Diboron tetrachloride InChI=1S/B2Cl4/c3-1(4)2(5)6 LCWVIHDXYOFGEG-UHFFFAOYSA-N ClB(Cl)B(Cl)Cl   Diboron tetrachloride; Dichloroborane; perchlorodiborane
13701672 B2Cl4 Diboron tetrachloride InChI=1S/B2Cl4/c3-1(4)2(5)6 LCWVIHDXYOFGEG-UHFFFAOYSA-N ClB(Cl)B(Cl)Cl   Diboron tetrachloride; Dichloroborane; perchlorodiborane
127184 C2Cl4 Tetrachloroethylene InChI=1S/C2Cl4/c3-1(4)2(5)6 CYTYCFOTNPOANT-UHFFFAOYSA-N ClC(Cl)=C(Cl)Cl   1,1,2,2-Tetrachloroethene; 1,1,2,2-Tetrachloroethylene; Ankilostin; Antisal 1; Antisol 1; Carbon bichloride; Carbon dichloride; Czterochloroetylen; Didakene; Dilatin PT; Dow-per; ENT 1,860; Ethene, tetrachloro-; Ethylene tetrachloride; Ethylene, tetrachloro-; Fedal-Un; Freon 1110; NCI-C04580; Nema; Nema, veterinary; PER; Perawin; PERC; Perchloorethyleen, per; Perchlor; Perchloraethylen, per; Perchlorethylene; Perchlorethylene, per; Perchloroethylene; Perclene; Perclene D; Percloroetilene; Percosolve; Perk; Perklone; PerSec; Rcra waste number U210; Tetlen; Tetracap; Tetrachlooretheen; Tetrachloraethen; Tetrachlorethylene; Tetrachloroethane; Tetrachloroethene; Tetrachloroethylene; Tetrachloroethylene mos; Tetracloroetene; Tetraguer; Tetraleno; Tetralex; Tetravec; Tetroguer; Tetropil; UN 1897; perchloroethene
75876 CCl3CHO trichloroacetaldehyde InChI=1S/C2HCl3O/c3-2(4,5)1-6/h1H HFFLGKNGCAIQMO-UHFFFAOYSA-N O=CC(Cl)(Cl)Cl   Chloral; Acetaldehyde, trichloro-; Trichloroethanal; 2,2,2-Trichloroethanal; Cloralio; Rcra waste number U034; UN 2075; 2,2,2-Trichloroacetaldehyde
75887 CF3CH2Cl 2,2,2-Trifluoroethyl chloride InChI=1S/C2H2ClF3/c3-1-2(4,5)6/h1H2 CYXIKYKBLDZZNW-UHFFFAOYSA-N FC(F)(F)CCl   Ethane, 2-chloro-1,1,1-trifluoro-; Genetron 133a; R 133a; 1-Chloro-2,2,2-Trifluoroethane; 1,1,1-Trifluoro-2-chloroethane; 1,1,1-Trifluoroethyl chloride; CFC 133a; 2-Chloro-1,1,1-trifluoroethane; FC 133a; Freon 133a; 2,2,2-Trifluorochloroethane
471432 CHCl2CHF2 1,1-dichloro-2,2-difluoroethane InChI=1S/C2H2Cl2F2/c3-1(4)2(5)6/h1-2H ClC(Cl)C(F)F   Ethane, 1,1-dichloro-2,2-difluoro-
3187948 C4H3ClO Furan, 2-chloro InChI=1S/C4H3ClO/c5-4-2-1-3-6-4/h1-3H ClC1=CC=CO1   2-chlorofuran
50689173 C4H3ClO Furan,3-chloro InChI=1S/C4H3ClO/c5-4-1-2-6-3-4/h1-3H ClC1=COC=C1   3-chlorofuran
541413 C3H5ClO2 Carbonochloridic acid, ethyl ester InChI=1S/C3H5ClO2/c1-2-6-3(4)5/h2H2,1H3 RIFGWPKJUGCATF-UHFFFAOYSA-N O=C(Cl)OCC   Carbonochloridic acid, ethyl ester; Cathyl chloride; Chlorocarbonate D'ethyle; Chlorocarbonic acid, ethyl ester; Chloroformic acid, ethyl ester; Clhorameisensaeureaethylester; ECF; Ethoxycarbonyl chloride; Ethyl chlorocarbonate; Ethyl chloroformate; Ethylchloorformiaat; Ethyle, chloroformiat D'; Ethylester kyseliny chlormravenci; Etil clorocarbonato; Etil cloroformiato; Formic acid, chloro-, ethyl ester; TL 423; UN 1182; ethyl carbonochloridate
96184 C3H5Cl3 Propane, 1,2,3-trichloro- InChI=1S/C3H5Cl3/c4-1-3(6)2-5/h3H,1-2H2 CFXQEHVMCRXUSD-UHFFFAOYSA-N ClCC(Cl)CCl   1,2,3-Trichloropropane; Allyl trichloride; Glycerol trichlorohydrin; Glyceryl trichlorohydrin; NCI-C60220; Propane, 1,2,3-trichloro-; Trichlorohydrin; Trichloropropane
616217 C4H8Cl2 Butane, 1,2-dichloro- InChI=1S/C4H8Cl2/c1-2-4(6)3-5/h4H,2-3H2,1H3 PQBOTZNYFQWRHU-UHFFFAOYSA-N CC[C@@H](Cl)CCl   1,2-Dichlorobutane; Butane, 1,2-dichloro-
110565 C4H8Cl2 1,4-Dichlorobutane InChI=1S/C4H8Cl2/c5-3-1-2-4-6/h1-4H2 KJDRSWPQXHESDQ-UHFFFAOYSA-N ClCCCCCl   1,4-Dichlorobutane; Butane, 1,4-dichloro-; Tetramethylene chloride
4028562 C4H8Cl2 Butane, 2,3-dichloro-, (r*,s*)- InChI=1S/C4H8Cl2/c1-3(5)4(2)6/h3-4H,1-2H3/t3-,4+ RMISVOPUIFJTEO-ZXZARUISSA-N C[C@@H](Cl)[C@@H](Cl)C   Butane, 2,3-dichloro-, (R*,S*)-; Butane, 2,3-dichloro-, meso-; meso-2,3-Dichlorobutane; (2R,3S)-2,3-dichlorobutane
2211678 C4H8Cl2 Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)- InChI=1S/C4H8Cl2/c1-3(5)4(2)6/h3-4H,1-2H3/t3-,4-/m0/s1 RMISVOPUIFJTEO-IMJSIDKUSA-N C[C@@H](Cl)[C@H](Cl)C   (.+-.)-2,3-Dichlorobutane; (.+/-.)-2,3-Dichlorobutane; Butane, 2,3-dichloro-, (.+-.)-; Butane, 2,3-dichloro-, (.+/-.)-; Butane, 2,3-dichloro-, (R*,R*)-(.+-.)-; Butane, 2,3-dichloro-, (R*,R*)-(.+/-.)-; DL-2,3-Dichlorobutane; racemic-2,3-Dichlorobutane; (2R,3R)-2,3-dichlorobutane
1190223 C4H8Cl2 Butane, 1,3-dichloro- InChI=1S/C4H8Cl2/c1-4(6)2-3-5/h4H,2-3H2,1H3 QBGVARBIQGHVKR-UHFFFAOYSA-N C[C@@H](Cl)CCCl   1,3-Dichlorobutane; Butane, 1,3-dichloro-
628342 C4H9ClO 1-Chloro-2-ethoxyethane InChI=1S/C4H9ClO/c1-2-6-4-3-5/h2-4H2,1H3 GPTVQTPMFOLLOA-UHFFFAOYSA-N CCOCCCl   β-Chloroethyl ethyl ether; 1-Chloro-2-ethoxyethane; 2-Chlorodiethyl ether; 2-Chloroethoxyethane; 2-Chloroethyl ethyl ether; 2-Ethoxyethyl chloride; Ethane, 1-chloro-2-ethoxy-; Ether, 2-chloroethyl ethyl; Ethyl β-chloroethyl ether; beta-Chloroethyl ethyl ether
543599 C5H11Cl Pentane, 1-chloro- InChI=1S/C5H11Cl/c1-2-3-4-5-6/h2-5H2,1H3 SQCZQTSHSZLZIQ-UHFFFAOYSA-N CCCCCCl   1-Chloropentane; Amyl chloride; n-Amyl chloride; n-Pentyl chloride; Pentane, 1-chloro-; Pentyl chloride; UN 1107
7784363 AsF5 Arsenic pentafluoride InChI=1S/AsF5/c2-1(3,4,5)6 YBGKQGSCGDNZIB-UHFFFAOYSA-N F[As](F)(F)(F)F  
7789302 BrF5 bromine pentafluoride InChI=1S/BrF5/c2-1(3,4,5)6 XHVUVQAANZKEKF-UHFFFAOYSA-N FBr(F)(F)(F)F   Bromine fluoride; pentafluorobromine; Bromine pentafluoride
3551277 C7H7 cycloheptatrienyl radical InChI=1S/C7H7/c1-2-4-6-7-5-3-1/h1-7H WIQYRPSOJMHAHR-UHFFFAOYSA-N C1=CC=CC=C[CH]1   tropyl radical; tropyl
3551277 C7H7 cycloheptatrienyl radical InChI=1S/C7H7/c1-2-4-6-7-5-3-1/h1-7H WIQYRPSOJMHAHR-UHFFFAOYSA-N C1=CC=CC=C[CH]1   tropyl radical; tropyl
3551277 C7H7+ cycloheptatrienyl cation InChI=1S/C7H7/c1-2-4-6-7-5-3-1/h1-7H/q+1 OJOSABWCUVCSTQ-UHFFFAOYSA-N C1=CC=CC=C[CH+]1   tropylium; cyclohepta-2,4,6-trien-1-ylium
2154565 C6H5CH2 benzyl radical InChI=1S/C7H7/c1-7-5-3-2-4-6-7/h2-6H,1H2 SLRMQYXOBQWXCR-UHFFFAOYSA-N [CH2]C1=CC=CC=C1   methylphenyl; methyl,phenyl-; benzyl
121460 C7H8 Norbornadiene InChI=1S/C7H8/c1-2-7-4-3-6(1)5-7/h1-4,6-7H,5H2 SJYNFBVQFBRSIB-UHFFFAOYSA-N C1C2C=CC1C=C2   2,5-Norbornadiene; Bicyclo[2.2.1]hepta-2,5-diene; Bicyclo[2.2.1]heptadiene; 3,6-Methano-1,4-cyclohexadiene; Dicycloheptadiene; Bicyclo[2.2.1]-2,5-heptadiene; Bicyclo[2,2,1]-2,5-heptadiene
108883 C6H5CH3 toluene InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 YXFVVABEGXRONW-UHFFFAOYSA-N CC1=CC=CC=C1   Benzene,methyl; Methane,phenyl-; Toluolo; Methylbenzene; Methacide; Tolueen; Methylbenzol; Toluene; Toluen; Toluol; Phenylmethane; Antisal1a
279232 C7H12 Norbornane InChI=1S/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2 UMRZSTCPUPJPOJ-UHFFFAOYSA-N C1CC2CCC1C2   Bicyclo[2.2.1]heptane; Cyclohexane, 1,4-endo-methylene-; Norbornylane; Norcamphane; Norfenchane; Norsantane; 1,4-Endomethylenecyclohexane
291645 C7H14 cycloheptane InChI=1S/C7H14/c1-2-4-6-7-5-3-1/h1-7H2 DMEGYFMYUHOHGS-UHFFFAOYSA-N C1CCCCCC1  
142825 C7H16 heptane InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3 IMNFDUFMRHMDMM-UHFFFAOYSA-N CCCCCCC   n-Heptane; Dipropylmethane; heptane
589344 C7H16 3-methylhexane InChI=1S/C7H16/c1-4-6-7(3)5-2/h7H,4-6H2,1-3H3 VLJXXKKOSFGPHI-UHFFFAOYSA-N CC[C@H](C)CCC   Hexane, 3-methyl-; 2-Ethylpentane; 3-methylhexane
591764 C7H16 2-methylhexane InChI=1S/C7H16/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3 GXDHCNNESPLIKD-UHFFFAOYSA-N CC(C)CCCC   Isoheptane
109068 C6H7N 2-Methylpyridine InChI=1S/C6H7N/c1-6-4-2-3-5-7-6/h2-5H,1H3 BSKHPKMHTQYZBB-UHFFFAOYSA-N CC1=CC=CC=N1   2-Picoline; a-Methylpyridine; Pyridine, 2-methyl-; o-Picoline; Picoline; o-Methylpyridine; 2-methylpyridine
62533 C6H5NH2 aniline InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2 PAYRUJLWNCNPSJ-UHFFFAOYSA-N NC1=CC=CC=C1   Benzene, amino-; Benzene,amino-; NCI-C03736; AnilineOil; Phenylamine; Krystallin; Cyanol; Benzidam; Phenylamine; Anilina; BlueOil; Huile D'aniline; Aminobenzene; HuileD'aniline; Benzenamine; Benzidam; Anilina; Anilin; Aminophen; Aniline; Aminophen; Benzenamine; Krystallin; Anilin; Anyvim; Kyanol; Anyvim; Aminobenzene; Kyanol; Aniline Oil; Blue Oil; Cyanol
109057 C6H13N 2-Methylpiperidine InChI=1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3/t6-/m1/s1 NNWUEBIEOFQMSS-ZCFIWIBFSA-N C[C@@H]1CCCCN1   2-Pipecoline; a-Methylpiperidine; Pipicoline; Piperidine, 2-methyl-; a-Pipecolin; 2-Methylpiperidine
108918 C6H13N cyclohexanamine InChI=1S/C6H13N/c7-6-4-2-1-3-5-6/h6H,1-5,7H2 PAFZNILMFXTMIY-UHFFFAOYSA-N NC1CCCCC1   Cyclohexylamine; Aminocyclohexane; Aminohexahydrobenzene; Benzenamine, hexahydro-; Hexahydrobenzenamine Hexahydroaniline; Aniline, hexahydro-; CHA; UN 2357; 1-Aminocyclohexane; 1-Cyclohexylamine; cyclohexanamine
121448 C6H15N triethylamine InChI=1S/C6H15N/c1-4-7(5-2)6-3/h4-6H2,1-3H3 ZMANZCXQSJIPKH-UHFFFAOYSA-N CCN(CC)CC   Ethanamine, N,N-diethyl-; (Diethylamino)ethane; UN 1296; N,N-Diethylethanamine; Triaethylamin
10102031 N2O5 Dinitrogen pentoxide InChI=1S/N2O5/c3-1(4)7-2(5)6 ZWWCURLKEXEFQT-UHFFFAOYSA-N O=N(ON(=O)=O)=O   Nitrogen pentoxide; nitric anhydride
10102031 N2O5 Dinitrogen pentoxide InChI=1S/N2O5/c3-1(4)7-2(5)6 ZWWCURLKEXEFQT-UHFFFAOYSA-N O=N(ON(=O)=O)=O   Nitrogen pentoxide; nitric anhydride
108316 C4H2O3 Maleic Anhydride InChI=1S/C4H2O3/c5-3-1-2-4(6)7-3/h1-2H FPYJFEHAWHCUMM-UHFFFAOYSA-N O=C(C=C1)OC1=O   2,5-Furandione; cis-Butenedioic Anhydride; Dihydro-2,5-dioxofuran; Maleic acid anhydride; Toxilic anhydride; UN 2215; furan-2,5-dione
930609 C5H4O2 4-Cyclopentene-1,3-dione InChI=1S/C5H4O2/c6-4-1-2-5(7)3-4/h1-2H,3H2 MCFZBCCYOPSZLG-UHFFFAOYSA-N O=C1CC(C=C1)=O   2-Cyclopentene-1,4-dione; 2-cyclopenten-1,4-dione; 4-Cyclopenten-1,3-dione; Cyclopent-2-en-1,4-dione; cyclopent-2-ene-1,4-dione; cyclopent-4-ene-1,3-dione
980101 C5H4O2 furfural InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H HYBBIBNJHNGZAN-UHFFFAOYSA-N O=CC1=CC=CO1   2-Furancarboxaldehyde; 2-Furaldehyde; a-Furole; Fural; Furaldehyde; Furale; Furancarbonal; Furfuraldehyde; Furfurylaldehyde; Furfurole; Furole; 2-Formylfuran; 2-Furanaldehyde; 2-Furancarbonal; 2-Furfural; 2-Furfuraldehyde; 2-Furylaldehyde; Furol; 2-Furylmethanal; UN 1199; furan-2-carbaldehyde
980101 C5H4O2 furfural InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H HYBBIBNJHNGZAN-UHFFFAOYSA-N O=CC1=CC=CO1   2-Furancarboxaldehyde; 2-Furaldehyde; a-Furole; Fural; Furaldehyde; Furale; Furancarbonal; Furfuraldehyde; Furfurylaldehyde; Furfurole; Furole; 2-Formylfuran; 2-Furanaldehyde; 2-Furancarbonal; 2-Furfural; 2-Furfuraldehyde; 2-Furylaldehyde; Furol; 2-Furylmethanal; UN 1199; furan-2-carbaldehyde
2122465 C6H5O phenoxy radical InChI=1S/C6H5O/c7-6-4-2-1-3-5-6/h1-5H KHUXNRRPPZOJPT-UHFFFAOYSA-N [O]C1=CC=CC=C1  
9000004 C5H5NO 3(2H)-Pyridinone InChI=1S/C5H5NO/c7-5-2-1-3-6-4-5/h1-3H,4H2 GKECDORWWXXNRY-UHFFFAOYNA-N O=C1CN=CC=C1  
9000004 C5H5NO 3(2H)-Pyridinone InChI=1/C5H5NO/c7-5-2-1-3-6-4-5/h1-3H,4H2 GKECDORWWXXNRY-UHFFFAOYNA-N O=C1CN=CC=C1  
9000015 C5H5NO 3(6H)-Pyridinone InChI=1S/C5H5NO/c7-5-2-1-3-6-4-5/h1-2,4H,3H2 LFKQAJAEPPQNRV-UHFFFAOYNA-N O=C1C=NCC=C1  
9000015 C5H5NO 3(6H)-Pyridinone InChI=1/C5H5NO/c7-5-2-1-3-6-4-5/h1-2,4H,3H2 LFKQAJAEPPQNRV-UHFFFAOYNA-N O=C1C=NCC=C1  
9000026 C5H5NO 3(4H)-Pyridinone InChI=1S/C5H5NO/c7-5-2-1-3-6-4-5/h1,3-4H,2H2 ADEKJVNFIQUGRR-UHFFFAOYSA-N O=C1C=NC=CC1   pyridin-3(4H)-one
9000037 C5H5NO 2(5H)-Pyridinone InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1,3-4H,2H2 CSMMEAYSMCAJPJ-UHFFFAOYSA-N O=C1C=CCC=N1  
9000037 C5H5NO 2(5H)-Pyridinone InChI=1/C5H5NO/c7-5-3-1-2-4-6-5/h1,3-4H,2H2 CSMMEAYSMCAJPJ-UHFFFAOYSA-N O=C1C=CCC=N1  
9000048 C5H5NO 2(3H)-Pyridinone InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-2,4H,3H2 FPGGLMIYNLQOID-UHFFFAOYNA-N O=C1CC=CC=N1  
9000048 C5H5NO 2(3H)-Pyridinone InChI=1/C5H5NO/c7-5-3-1-2-4-6-5/h1-2,4H,3H2 FPGGLMIYNLQOID-UHFFFAOYNA-N O=C1CC=CC=N1  
9000059 C5H5NO 4(3H)-Pryidinone InChI=1S/C5H5NO/c7-5-1-3-6-4-2-5/h1,3-4H,2H2 MPOYBFYHRQBZPM-UHFFFAOYNA-N O=C1CC=NC=C1  
9000059 C5H5NO 4(3H)-Pryidinone InChI=1/C5H5NO/c7-5-1-3-6-4-2-5/h1,3-4H,2H2 MPOYBFYHRQBZPM-UHFFFAOYNA-N O=C1CC=NC=C1  
9000060 C5H5NO 4(1H)-Pryidinone InChI=1S/C5H5NO/c7-5-1-3-6-4-2-5/h1-4H,(H,6,7) GCNTZFIIOFTKIY-UHFFFAOYSA-N O=C1C=CNC=C1  
9000060 C5H5NO 4(1H)-Pryidinone InChI=1/C5H5NO/c7-5-1-3-6-4-2-5/h1-4H,(H,6,7)/f/h6H GCNTZFIIOFTKIY-BRMMOCHJNA-N O=C1C=CNC=C1  
109002 C5H5NO 3-Pyridinol InChI=1S/C5H5NO/c7-5-2-1-3-6-4-5/h1-4,7H GRFNBEZIAWKNCO-UHFFFAOYSA-N OC1=CC=CN=C1   3-Hydroxypyridine; -Hydroxypyridine; 3-Oxopyridine; 3-Pyridol; 3-Pyridone; pyridin-3-ol
109002 C5H5NO 3-Pyridinol InChI=1/C5H5NO/c7-5-2-1-3-6-4-5/h1-4,7H GRFNBEZIAWKNCO-UHFFFAOYNA-N OC1=CC=CN=C1   3-Hydroxypyridine; -Hydroxypyridine; 3-Oxopyridine; 3-Pyridol; 3-Pyridone; pyridin-3-ol
109104 C5H5NO 2-Pyridinol InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7) UBQKCCHYAOITMY-UHFFFAOYSA-N OC1=NC=CC=C1  
109104 C5H5NO 2-Pyridinol InChI=1/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)/f/h7H UBQKCCHYAOITMY-QDQILVOLNA-N OC1=NC=CC=C1  
626642 C5H5NO 4-Pyridinol InChI=1S/C5H5NO/c7-5-1-3-6-4-2-5/h1-4H,(H,6,7) GCNTZFIIOFTKIY-UHFFFAOYSA-N OC1=CC=NC=C1  
626642 C5H5NO 4-Pyridinol InChI=1/C5H5NO/c7-5-1-3-6-4-2-5/h1-4H,(H,6,7)/f/h7H GCNTZFIIOFTKIY-QDQILVOLNA-N OC1=CC=NC=C1  
72762006 C5H5NO 2(1H)-Pyridinone InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7) UBQKCCHYAOITMY-UHFFFAOYSA-N O=C1C=CC=CN1  
72762006 C5H5NO 2(1H)-Pyridinone InChI=1/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)/f/h6H UBQKCCHYAOITMY-BRMMOCHJNA-N O=C1C=CC=CN1  
24599573 C6H6O 2,4-Cyclohexadienone InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-4H,5H2 WQPDQJCBHQPNCZ-UHFFFAOYSA-N O=C1C=CC=CC1  
108952 C6H5OH phenol InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H ISWSIDIOOBJBQZ-UHFFFAOYSA-N OC1=CC=CC=C1   Benzenol; Hydroxybenzene; Monophenol; Paoscle; Phenylhydroxide; Oxybenzene; Phenylicacid; PhOH; Fenolo; Phenole; Carbolsaure; Phenolalcohol; Benzophenol; Phenol; Carbolicacid; Fenol; Phenylhydrate; Phenylicalcohol; Monohydroxybenzene; Acidecarbolique; Phenylalcohol; Izal; Phenicacid; Benzene,hydroxy-
5664335 C6H6O 2,5-Cyclohexadienone InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h2-5H,1H2 WGHKKEJHRMUKDK-UHFFFAOYSA-N O=C1C=CCC=C1  
56451 HO2CCHNH2CH2OH Serine InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 MTCFGRXMJLQNBG-UWTATZPHSA-N OC[C@@H](N)C(O)=O   D-Serine; a-Amino--hydroxypropionic acid
56451 HO2CCHNH2CH2OH Serine InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m1/s1/f/h6H MTCFGRXMJLQNBG-QKGSACKDNA-N OC[C@@H](N)C(O)=O   D-Serine; a-Amino--hydroxypropionic acid
123546 C5H8O2 Acetylacetone InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3 YRKCREAYFQTBPV-UHFFFAOYSA-N CC(CC(C)=O)=O   2,4-Pentanedione; Acetoacetone; Diacetylmethane; Pentane-2,4-dione; 2-Propanone, acetyl-; 2,4-Dioxopentane; 2,4-Pentadione; Acetone, acetyl-; ACAC; Pentanedione; Pentanedione-2,4; Acetyl 2-propanone; UN 2310; pentan-2,4-dione; 2,4-Pentandione
108941 C6H10O cyclohexanone InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2 JHIVVAPYMSGYDF-UHFFFAOYSA-N O=C1CCCCC1  
111433 C3H7OC3H7 di-n-propyl ether InChI=1S/C6H14O/c1-3-5-7-6-4-2/h3-6H2,1-2H3 POLCUAVZOMRGSN-UHFFFAOYSA-N CCCOCCC   Propyl ether; Dipropyl ether; n-Propyl ether; 1-Propoxypropane; Propane, 1,1'-oxybis-
111433 C3H7OC3H7 di-n-propyl ether InChI=1S/C6H14O/c1-3-5-7-6-4-2/h3-6H2,1-2H3 POLCUAVZOMRGSN-UHFFFAOYSA-N CCCOCCC   Propyl ether; Dipropyl ether; n-Propyl ether; 1-Propoxypropane; Propane, 1,1'-oxybis-
354347 CF3COF trifluoroacetyl fluoride InChI=1S/C2F4O/c3-1(7)2(4,5)6 DCEPGADSNJKOJK-UHFFFAOYSA-N O=C(F)C(F)(F)F  
462066 C6H5F Fluorobenzene InChI=1S/C6H5F/c7-6-4-2-1-3-5-6/h1-5H PYLWMHQQBFSUBP-UHFFFAOYSA-N FC1=CC=CC=C1   UN 2387; Phenyl fluoride; Benzene, fluoro-; Monofluorobenzene; fluorobenzene
16919189 PF6- Hexafluorophosphate ion InChI=1S/F6P/c1-7(2,3,4,5)6/q-1 LJQLCJWAZJINEB-UHFFFAOYSA-N [F-][P+5]([F-])([F-])([F-])([F-])[F-]   Phosphate(1-), hexafluoro-; hexafluorophosphate(V)
2551624 SF6 Sulfur Hexafluoride InChI=1S/F6S/c1-7(2,3,4,5)6 SFZCNBIFKDRMGX-UHFFFAOYSA-N FS(F)(F)(F)(F)F  
354325 CF3COCl trifluoroacetyl chloride InChI=1S/C2ClF3O/c3-1(7)2(4,5)6 PNQBEPDZQUOCNY-UHFFFAOYSA-N O=C(Cl)C(F)(F)F  
13780579 SF5Cl sulfur chloropentafluoride InChI=1S/ClF5S/c1-7(2,3,4,5)6 GSYNTTDHMKSMFY-UHFFFAOYSA-N ClS(F)(F)(F)(F)F   sulphur chloride pentafluoride
306832 CF3CHCl2 1,1-Dichloro-2,2,2-trifluoroethane InChI=1S/C2HCl2F3/c3-1(4)2(5,6)7/h1H OHMHBGPWCHTMQE-UHFFFAOYSA-N FC(F)(F)C(Cl)Cl   Dichlorotrifluoromethylmethane; Ethane, 2,2-dichloro-1,1,1-trifluoro-; 1,1,1-Trifluoro-2,2-dichloroethane; 2,2-Dichloro-1,1,1-trifluoroethane; Dichlorotrifluoroethane; Freon 123; HCFC-123; R 123
2837890 CF3CHFCl 1,1,1,2-tetrafluorochloroethane InChI=1S/C2HClF4/c3-1(4)2(5,6)7/h1H BOUGCJDAQLKBQH-UHFFFAOYSA-N FC(F)(F)[CH](Cl)F   2-Chloro-1,1,1,2-tetrafluoroethane; Ethane, 2-chloro-1,1,1,2-tetrafluoro-; R 124; 1-chloro-1,2,2,2-tetrafluoroethane
108907 C6H5Cl chlorobenzene InChI=1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H MVPPADPHJFYWMZ-UHFFFAOYSA-N ClC1=CC=CC=C1   Chlorobenzen; Monochlorobenzene; Chlorobenzene,mono-; Monochloorbenzeen; Chloorbenzeen; Chlorobenzene; Monochlorbenzol; Chlorbenzene; Benzenechloride; Chlorobenzenu; Clorobenzene; MCB; Monoclorobenzene; Monochlorbenzene; PhenylChloride; Benzene, chloro-; Chlorobenzol; Chlorbenzol
7783791 SeF6 Selenium hexafluoride InChI=1S/F6Se/c1-7(2,3,4,5)6 LMDVZDMBPZVAIV-UHFFFAOYSA-N F[Se](F)(F)(F)(F)F  
108861 C6H5Br bromobenzene InChI=1S/C6H5Br/c7-6-4-2-1-3-5-6/h1-5H QARVLSVVCXYDNA-UHFFFAOYSA-N BrC1=CC=CC=C1   Benzene, bromo-; Monobromobenzene; Phenyl bromide; NCI-C55492; UN 2514; bromobenzene
250259 C8H6 Pentalene InChI=1S/C8H6/c1-3-7-5-2-6-8(7)4-1/h1-6H GUVXZFRDPCKWEM-UHFFFAOYSA-N C12=CC=CC1=CC=C2  
536743 C6H5CCH phenylacetylene InChI=1S/C8H6/c1-2-8-6-4-3-5-7-8/h1,3-7H UEXCJVNBTNXOEH-UHFFFAOYSA-N C#CC1=CC=CC=C1   Phenylethyne; Ethynylbenzene
6249236 C8H6 Calicene InChI=1S/C8H6/c1-2-4-7(3-1)8-5-6-8/h1-6H ZXWMPJFQZJXFQN-UHFFFAOYSA-N C1(C=CC=C1)=C2C=C2   1,3-Cyclopentadiene, 5-(2-cyclopropen-1-ylidene)-; Pentatriafulvalene; Triapentafulvalene; 5-(2-cyclopropen-1-ylidene)- (7CI); 5-(2-Cyclopropen-1-ylidene)cyclopentadiene
4026237 C8H6 benzocyclobutadiene InChI=1S/C8H6/c1-2-4-8-6-5-7(8)3-1/h1-6H WHEATZOONURNGF-UHFFFAOYSA-N C12=C(C=C2)C=CC=C1   Bicyclo[4.2.0]octa-1,3,5,7-tetraene
629209 C8H8 cyclooctatetraene InChI=1S/C8H8/c1-2-4-6-8-7-5-3-1/h1-8H/b2-1-,3-1-,4-2-,5-3-,6-4-,7-5-,8-6-,8-7- KDUIUFJBNGTBMD-BONZMOEMSA-N C1=C\C=C/C=C\C=C/1   1,3,5,7-Cyclooctatetraene; UN 2358; [8]Annulene; cot; (1Z,3Z,5Z,7Z)-cycloocta-1,3,5,7-tetraene
277101 C8H8 cubane InChI=1S/C8H8/c1-2-5-3(1)7-4(1)6(2)8(5)7/h1-8H TXWRERCHRDBNLG-UHFFFAOYSA-N C12C3C4C1C5C4C3C25  
100425 C6H5CHCH2 Styrene InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2 PPBRXRYQALVLMV-UHFFFAOYSA-N C=CC1=CC=CC=C1   Styreen; Styrolene; Benzene, vinyl-; Styron; Vinylbenzene; Styrol; Stirolo; Cinnaminol; Cinnamenol; Phenylethylene; Styrole; Vinylbenzen; Styrol; Vinylbenzol; Styren; Phenylethene; Phenethylene; NCI-C02200; Benzene, ethenyl-; Cinnamol; Cinnamene; Ethenylbenzene; Ethylene, phenyl-; styrene
100414 C6H5CH2CH3 Ethylbenzene InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3 YNQLUTRBYVCPMQ-UHFFFAOYSA-N CCC1=CC=CC=C1   UN 1175; Ethylbenzeen; Etylobenzen; Etilbenzene; a-Methyltoluene; Aethylbenzol; NCI-C56393; Benzene, ethyl-; Phenylethane; Ethylbenzol; ethylbenzene
108383 CH3C6H4CH3 meta-xylene InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3 IVSZLXZYQVIEFR-UHFFFAOYSA-N CC1=CC(C)=CC=C1   Benzene, 1,3-dimethyl-; m-Xylene; m-Dimethylbenzene; m-Xylol; 1,3-Dimethylbenzene; 1,3-Xylene; 2,4-Xylene; m-Methyltoluene; meta-Xylene; UN 1307
106423 CH3C6H4CH3 paraxylene InChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3 URLKBWYHVLBVBO-UHFFFAOYSA-N CC1=CC=C(C)C=C1   Benzene, 1,4-dimethyl-; p-Xylene; p-Dimethylbenzene; p-Xylol; 1,4-Dimethylbenzene; 1,4-Xylene; p-Methyltoluene; para-Xylene; Chromar; Scintillar; UN 1307; 4-Methyltoluene; 1,4-dimethyl-benzene
280331 C8H14 Bicyclo[2.2.2]octane InChI=1S/C8H14/c1-2-8-5-3-7(1)4-6-8/h7-8H,1-6H2/t7-,8+ GPRLTFBKWDERLU-OCAPTIKFSA-N C1(CC2)CCC2CC1   1,4-Endoethylenecyclohexane; Cyclohexane, 1,4-endo-(1,2-ethanediyl)-; Bicyclo[2.2.2]octane
280331 C8H14 Bicyclo[2.2.2]octane InChI=1S/C8H14/c1-2-8-5-3-7(1)4-6-8/h7-8H,1-6H2/t7-,8+ GPRLTFBKWDERLU-OCAPTIKFSA-N C1(CC2)CCC2CC1   1,4-Endoethylenecyclohexane; Cyclohexane, 1,4-endo-(1,2-ethanediyl)-; Bicyclo[2.2.2]octane
292648 C8H16 cyclooctane InChI=1S/C8H16/c1-2-4-6-8-7-5-3-1/h1-8H2 WJTCGQSWYFHTAC-UHFFFAOYSA-N C1CCCCCCC1   ciclooctane
111659 C8H18 Octane InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3 TVMXDCGIABBOFY-UHFFFAOYSA-N CCCCCCCC   n-Octane; n-C8H18; UN 1262; Oktan; Oktanen; Ottani; Octane
594821 (CH3)3CC(CH3)3 tetramethylbutane InChI=1S/C8H18/c1-7(2,3)8(4,5)6/h1-6H3 OMMLUKLXGSRPHK-UHFFFAOYSA-N CC(C)(C)C(C)(C)C   Ethane, hexamethyl-; Hexamethylethane; 2,2,3,3-Tetramethylbutane; Butane, 2,2,3,3-tetramethyl-
594821 (CH3)3CC(CH3)3 tetramethylbutane InChI=1S/C8H18/c1-7(2,3)8(4,5)6/h1-6H3 OMMLUKLXGSRPHK-UHFFFAOYSA-N CC(C)(C)C(C)(C)C   Ethane, hexamethyl-; Hexamethylethane; 2,2,3,3-Tetramethylbutane; Butane, 2,2,3,3-tetramethyl-
100470 C6H5CN phenyl cyanide InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H JFDZBHWFFUWGJE-UHFFFAOYSA-N N#CC1=CC=CC=C1   Benzonitrile; Cyanobenzene; Benzene, cyano-; Benzenenitrile; Fenylkyanid; UN 2224
280579 C6H12N2 Triethylenediamine InChI=1S/C6H12N2/c1-2-8-5-3-7(1)4-6-8/h1-6H2 IMNIMPAHZVJRPE-UHFFFAOYSA-N N1(CC2)CCN2CC1   1,4-Diazabicyclo[2.2.2]octane; Bicyclo[2.2.2]-1,4-diazaoctane; Dabco; Dabco 33LV; N,N'-endo-Ethylenepiperazine; 1,4-Diaza[2.2.2]bicyclooctane; 1,4-Ethylenepiperazine; ,4-Diazabicyclo[2,2,2] octane; Bicyclo[2.2.2]octane, 1,4-diaza-; 1,4-Diazobicyclo(2.2.2)octane; Bicyclo(2,2,2)-1,4-diazaoctane
280579 C6H12N2 Triethylenediamine InChI=1S/C6H12N2/c1-2-8-5-3-7(1)4-6-8/h1-6H2 IMNIMPAHZVJRPE-UHFFFAOYSA-N N1(CC2)CCN2CC1   1,4-Diazabicyclo[2.2.2]octane; Bicyclo[2.2.2]-1,4-diazaoctane; Dabco; Dabco 33LV; N,N'-endo-Ethylenepiperazine; 1,4-Diaza[2.2.2]bicyclooctane; 1,4-Ethylenepiperazine; ,4-Diazabicyclo[2,2,2] octane; Bicyclo[2.2.2]octane, 1,4-diaza-; 1,4-Diazobicyclo(2.2.2)octane; Bicyclo(2,2,2)-1,4-diazaoctane
106514 C6H4O2 parabenzoquinone InChI=1S/C6H4O2/c7-5-1-2-6(8)4-3-5/h1-4H AZQWKYJCGOJGHM-UHFFFAOYSA-N O=C(C=C1)C=CC1=O   2,5-Cyclohexadiene-1,4-dione; p-Quinone; Chinone; Quinone; 1,4-Benzoquinone; 1,4-Cyclohexadienedione; Benzoquinone
66228 C4H4N2O2 Uracil InChI=1S/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8) ISAKRJDGNUQOIC-UHFFFAOYSA-N O=C(N1)C=CNC1=O   2,4(1H,3H)-Pyrimidinedione; Pirod; Pyrod; Ura; 2,4-Dihydroxypyrimidine; 2,4-Dioxopyrimidine; 2,4-Pyrimidinediol; 2,4-Pyrimidinedione; 2,6-Dihydroxypyrimidine; 1H-Pyrimidine-2,4-dione; 2,(1H,3H)-Pyriminedione; 2,4-Dioxypyrimidine; 4-Hydroxy-2(1H)-pyrimidinone; pyrimidine-2,4(1H,3H)-dione
66228 C4H4N2O2 Uracil InChI=1/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)/f/h5-6H ISAKRJDGNUQOIC-JYEHRPOANA-N O=C(N1)C=CNC1=O   2,4(1H,3H)-Pyrimidinedione; Pirod; Pyrod; Ura; 2,4-Dihydroxypyrimidine; 2,4-Dioxopyrimidine; 2,4-Pyrimidinediol; 2,4-Pyrimidinedione; 2,6-Dihydroxypyrimidine; 1H-Pyrimidine-2,4-dione; 2,(1H,3H)-Pyriminedione; 2,4-Dioxypyrimidine; 4-Hydroxy-2(1H)-pyrimidinone; pyrimidine-2,4(1H,3H)-dione
100527 C6H5CHO benzaldehyde InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H HUMNYLRZRPPJDN-UHFFFAOYSA-N O=CC1=CC=CC=C1   Ethereal oil of bitter almonds; Benzene carbaldehyde; Benzenecarbonal; Benzene methylal; Phenylmethanal; benzaldehyde; Almond Oil; Benzoic aldehyde; Benzoyl hydride
100663 C6H5OCH3 Anisole InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3 RDOXTESZEPMUJZ-UHFFFAOYSA-N COC1=CC=CC=C1   Methyl phenyl ether; Ether, methyl phenyl-; Phenyl methyl ether; Anizol; UN 2222; Anisol; Phenoxymethane; methoxybenzene; Benzene, methoxy-; anisole
142621 C6H12O2 Hexanoic acid InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8) FUZZWVXGSFPDMH-UHFFFAOYSA-N CCCCCC(O)=O   Caproic acid; n-Caproic acid; n-Hexanoic acid; n-Hexoic acid; n-Hexylic acid; Butylacetic acid; Capronic acid; Hexoic acid; Pentiformic acid; Pentylformic acid; 1-Pentanecarboxylic acid; Pentane-1-carboxylic acid; 1-Hexanoic acid; Pentanecarboxylic acid; Hexanoic acid
598981 C6H12O2 Methyl pivalate InChI=1S/C6H12O2/c1-6(2,3)5(7)8-4/h1-4H3 CNMFHDIDIMZHKY-UHFFFAOYSA-N CC(C)(C)C(OC)=O   Propanoic acid, 2,2-dimethyl-, methyl ester; Methyl trimethylacetate; 2,2-Dimethylpropanoic acid methyl ester; tert-C4H9COOCH3; Methyl pivalate
76164 C2F6 hexafluoroethane InChI=1S/C2F6/c3-1(4,5)2(6,7)8 WMIYKQLTONQJES-UHFFFAOYSA-N FC(F)(C(F)(F)F)F  
57070334 C4F4 tetrafluorcyclobutadiene InChI=1S/C4F4/c5-1-2(6)4(8)3(1)7 CZCWNUQRLNESIL-UHFFFAOYSA-N FC1=C(F)C(F)=C1F  
57070334 C4F4 tetrafluorcyclobutadiene InChI=1S/C4F4/c5-1-2(6)4(8)3(1)7 CZCWNUQRLNESIL-UHFFFAOYSA-N FC1=C(F)C(F)=C1F  
540363 C6H4F2 1,4-difluorobenzene InChI=1S/C6H4F2/c7-5-1-2-6(8)4-3-5/h1-4H QUGUFLJIAFISSW-UHFFFAOYSA-N FC1=CC=C(F)C=C1   Benzene, p-difluoro-; p-Difluorobenzene; Benzene, 1,4-difluoro-; para-Difluorobenzene; 1,4-difluorobenzene
367113 C6H4F2 orthodifluorobenzene InChI=1S/C6H4F2/c7-5-3-1-2-4-6(5)8/h1-4H GOYDNIKZWGIXJT-UHFFFAOYSA-N FC1=CC=CC=C1F   Benzene, 1,2-difluoro-; Benzene, o-difluoro-; o-Difluorobenzene; 1,2-Difluorobenzene; ortho-Difluorobenzene
372189 C6H4F2 metadifluorobenzene InChI=1S/C6H4F2/c7-5-2-1-3-6(8)4-5/h1-4H UEMGWPRHOOEKTA-UHFFFAOYSA-N FC1=CC=CC(F)=C1   Benzene, 1,3-difluoro-; Benzene, m-difluoro- Benzene, m-difluoro-; m-Difluorobenzene; 1,3-Difluorobenzene; meta-Difluorobenzene
10544500 S8 Octasulfur InChI=1S/S8/c1-2-4-6-8-7-5-3-1 JLQNHALFVCURHW-UHFFFAOYSA-N S1SSSSSSS1   Cyclic octaatomic sulfur; Sulfur molecule; Cyclooctasulfur; Sulfur (S8); Sulfur; Octathiocane; Orthorhombic sulfur; Sulfur octamer; Cyclooctasulphur
13845120 Al2Cl6 Aluminum, di-μ-chlorotetrachlorodi- InChI=1S/2Al.4ClH.2Cl/h;;4*1H;;/q2*+2;;;;;;/p-4 GHSXCATXXREJIA-UHFFFAOYSA-J Cl[Al]1(Cl)Cl[Al](Cl)(Cl)Cl1   Aluminum chloride; Aluminum chloride, dimer; dialuminum hexachloride
374072 CF3CFCl2 1,1-Dichlorotetrafluoroethane InChI=1S/C2Cl2F4/c3-1(4,5)2(6,7)8 BAMUEXIPKSRTBS-UHFFFAOYSA-N ClC(F)(Cl)C(F)(F)F   Ethane, 1,1-dichloro-1,2,2,2-tetrafluoro-; Ethane, 1,1-dichlorotetrafluoro-; Frigen 114A; 1,1-Dichloro-1,2,2,2-tetrafluoroethane; 1,1,1,2-Tetrafluoro-2,2-dichloroethane
76131 CF2ClCFCl2 Ethane, 1,1,2-trichloro-1,2,2-trifluoro- InChI=1S/C2Cl3F3/c3-1(4,6)2(5,7)8 AJDIZQLSFPQPEY-UHFFFAOYSA-N FC(Cl)(Cl)C(F)(F)Cl   Freon 113; 1,1,2-Trichloro-1,2,2-Trifluoroethane; Freon TF; 1,1,2-trichlorotrifluoroethane; CFC-113
76142 CF2ClCF2Cl 1,2-Dichloro-1,1,2,2-tetrafluoroethane InChI=1S/C2Cl2F4/c3-1(5,6)2(4,7)8 DDMOUSALMHHKOS-UHFFFAOYSA-N ClC(F)(F)C(F)(F)Cl   Ethane, 1,2-dichloro-1,1,2,2-tetrafluoro-; Dichlorotetrafluoroethane; Ethane, 1,2-dichlorotetrafluoro-; s-Dichlorotetrafluoroethane; Arcton 114; Fluorocarbon 114; Freon 114; CFC-114; Dichloro-1,1,2,2-tetrafluoroethane; Refrigerant R114; 1,2-dichloro-1,1,2,2-tetrafluoroethane
76153 CF3CF2Cl pentafluorochloroethane InChI=1S/C2ClF5/c3-1(4,5)2(6,7)8 RFCAUADVODFSLZ-UHFFFAOYSA-N FC(F)(F)C(F)(Cl)F   Ethane, chloropentafluoro-; Pentafluoroethyl chloride; F-115; Fluorocarbon 115; Freon 115; FC 115; R 115; 1-Chloro-1,1,2,2,2-Pentafluoroethane; Chloropentafluoroethane; Monochloropentafluoroethane; 1-chloro-1,1,2,2,2-pentafluoroethane
67721 C2Cl6 hexachloroethane InChI=1S/C2Cl6/c3-1(4,5)2(6,7)8 VHHHONWQHHHLTI-UHFFFAOYSA-N ClC(Cl)(Cl)C(Cl)(Cl)Cl   Avlothane; Distokal; Hexachlorethane; Mottenhexe; Perchloroethane; Phenohep; Ethane hexachloride; 1,1,1,2,2,2-Hexachloroethane; Hexachlor-aethan; NCI-C04604; NA 9037; Rcra waste number U131; Distopan; Egitol; Falkitol; Fasciolin
541731 C6H4Cl2 1,3-dichlorobenzene InChI=1S/C6H4Cl2/c7-5-2-1-3-6(8)4-5/h1-4H ZPQOPVIELGIULI-UHFFFAOYSA-N ClC1=CC(Cl)=CC=C1  
95136 C9H8 Indene InChI=1S/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H2 YBYIRNPNPLQARY-UHFFFAOYSA-N C12=C(C=CC2)C=CC=C1   1H-indene; benzocyclopentadiene
14867835 C9H8 spiro[4.4]nona-1,3,6,8-tetraene InChI=1S/C9H8/c1-2-6-9(5-1)7-3-4-8-9/h1-8H CLZMRBFGNUYTSN-UHFFFAOYSA-N C12(C=CC=C2)C=CC=C1  
103651 C9H12 n-propyl benzene InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3 ODLMAHJVESYWTB-UHFFFAOYSA-N CCCC1=CC=CC=C1  
111842 C9H20 Nonane InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3 CCCCCCCCC  
24331097 C(CN)4 tetracyanomethane InChI=1S/C5N4/c6-1-5(2-7,3-8)4-9 XKGUKYPCHPHAJL-UHFFFAOYSA-N N#CC(C#N)(C#N)C#N   Methanetetracarbonitrile
120730 C5H4N4 purine InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9) KDCGOANMDULRCW-UHFFFAOYSA-N c1c2c(nc[nH]2)ncn1  
120729 C8H7N Indole InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H SIKJAQJRHWYJAI-UHFFFAOYSA-N C12=C(C=CC=C2)C=CN1   1H-Indole; Ketole; 1-Azaindene; 1-Benzazole; 2,3-Benzopyrrole; Benzopyrrole; Indol; 1-H-indol
108805 C3H3N3O3 cyanuric acid InChI=1S/C3H3N3O3/c7-1-4-2(8)6-3(9)5-1/h(H3,4,5,6,7,8,9) ZFSLODLOARCGLH-UHFFFAOYSA-N O=C(N1)NC(NC1=O)=O   1,3,5-Triazine-2,4,6(1H,3H,5H)-trione; Isocyanuric acid
98953 C6H5NO2 Nitrobenzene InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H LQNUZADURLCDLV-UHFFFAOYSA-N O=[N+]([O-])C1=CC=CC=C1   Nitrobenzeen; Nitrobenzen; U169; Essence of Myrbane; UN 1662; Mirbane oil; Nitrobenzol; Oil of Myrbane; NCI-C60082; Oil of Mirbane; Essence of Mirbane; Benzene, nitro-; nitrobenzene
65850 C6H5COOH benzoic acid InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9) WPYMKLBDIGXBTP-UHFFFAOYSA-N OC(=O)C1=CC=CC=C1   Benzenecarboxylic acid; Benzeneformic acid; Benzenemethanoic acid; Carboxybenzene; Phenylcarboxylic acid; benzoic acid
98862 CH3COC6H5 acetophenone InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3 KWOLFJPFCHCOCG-UHFFFAOYSA-N CC(C1=CC=CC=C1)=O   Ethanone, 1-phenyl-; Methyl phenyl ketone; Phenyl methyl ketone; 1-Phenylethanone; Acetylbenzene; Phenylethanone
98862 CH3COC6H5 acetophenone InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3 KWOLFJPFCHCOCG-UHFFFAOYSA-N CC(C1=CC=CC=C1)=O   Ethanone, 1-phenyl-; Methyl phenyl ketone; Phenyl methyl ketone; 1-Phenylethanone; Acetylbenzene; Phenylethanone
1489538 C6H3F3 Benzene trifluoride 123 InChI=1S/C6H3F3/c7-4-2-1-3-5(8)6(4)9/h1-3H AJKNNUJQFALRIK-UHFFFAOYSA-N FC1=C(F)C=CC=C1F   1,2,3-Trifluorobenzene
108770 C3Cl3N3 1,3,5-Triazine, 2,4,6-trichloro- InChI=1S/C3Cl3N3/c4-1-7-2(5)9-3(6)8-1 MGNCLNQXLYJVJD-UHFFFAOYSA-N ClC1=NC(Cl)=NC(Cl)=N1   s-Triazine, 2,4,6-trichloro-; s-Triazine trichloride; s-Trichlorotriazine; Cyanuric chloride; Cyanuric trichloride; Trichloro-s-triazine; Trichlorocyanidine; 1,3,5-Trichlorotriazine; 2,4,6-Trichloro-s-triazine; 2,4,6-Trichloro-1,3,5-triazine; 2,4,6-Trichlorotriazine; 2,4,6-Trichloro-sym-triazine; syn-Trichlotriazin; Chlorotriazine; Cyanuric acid chloride; sym-Trichlorotriazine; UN 2670; 1,3,5-Trichloro-2,4,6-triazine
91203 C10H8 naphthalene InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H UFWIBTONFRDIAS-UHFFFAOYSA-N C12=CC=CC=C1C=CC=C2   White tar; Camphor tar; Naftalen; Moth balls; NCI-C52904; Rcra waste number U165; UN 1334; UN 2304; Naphthaline; Tar camphor; Moth flakes; Naphthalin; Albocarbon; Naphthene; Dezodorator; naphthalene
275514 C10H8 Azulene InChI=1S/C10H8/c1-2-5-9-7-4-8-10(9)6-3-1/h1-8H CUFNKYGDVFVPHO-UHFFFAOYSA-N C12=CC=CC=CC1=CC=C2   Bicyclo[5.3.0]decapentaene; Cyclopentacycloheptene; Bicyclo(5.3.0)-1,3,5,7,9-decapentaene; azulene
275514 C10H8 Azulene InChI=1S/C10H8/c1-2-5-9-7-4-8-10(9)6-3-1/h1-8H CUFNKYGDVFVPHO-UHFFFAOYSA-N C12=CC=CC=CC1=CC=C2   Bicyclo[5.3.0]decapentaene; Cyclopentacycloheptene; Bicyclo(5.3.0)-1,3,5,7,9-decapentaene; azulene
281232 C10H16 adamantane InChI=1S/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2/t7-,8+,9-,10+ ORILYTVJVMAKLC-YNFQOJQRSA-N C1(C2)CC3CC(CC2C3)C1   Tricyclo[3.3.1.1(3,7)]decane; adamantane
670542 C6N4- tetracyanoethylene anion InChI=1S/C6N4/c7-1-5(2-8)6(3-9)4-10/q-1 ZNJBINVKRBADPY-UHFFFAOYSA-N N#CC(C#N)=C(C#N)[C]=[N-]  
670542 C6N4 Tetracyanoethylene InChI=1S/C6N4/c7-1-5(2-8)6(3-9)4-10 NLDYACGHTUPAQU-UHFFFAOYSA-N N#CC(C#N)=C(C#N)C#N   Ethenetetracarbonitrile; Ethene, tetracyano-; Ethylenetetracarbonitrile; Tetracyanoethene; TCNE; 1,1,2,2-Tetracyanoethene; 1,1,2,2-Tetracyanoethylene; Ethylene, tetracyano-; 1,1,2,2-Ethylenetetracarbonitrile
685632 C4F6 perfluorobutadiene InChI=1S/C4F6/c5-1(3(7)8)2(6)4(9)10 LGPPATCNSOSOQH-UHFFFAOYSA-N FC(F)=C(F)C(F)=C(F)F   Hexafluoro-1,3-butadiene; Perfluoro-1,3-butadiene; 1,3-Butadiene, 1,1,2,3,4,4-hexafluoro-; 1,1,2,3,4,4-Hexafluoro-1,3-butadiene
685632 C4F6 perfluorobutadiene InChI=1S/C4F6/c5-1(3(7)8)2(6)4(9)10 LGPPATCNSOSOQH-UHFFFAOYSA-N FC(F)=C(F)C(F)=C(F)F   Hexafluoro-1,3-butadiene; Perfluoro-1,3-butadiene; 1,3-Butadiene, 1,1,2,3,4,4-hexafluoro-; 1,1,2,3,4,4-Hexafluoro-1,3-butadiene
373808 SF5CF3 Sulfur, pentafluoro(trifluoromethyl)- InChI=1S/CF8S/c2-1(3,4)10(5,6,7,8)9 QIYZKVMAFMDRTP-UHFFFAOYSA-N FC(F)(F)S(F)(F)(F)(F)F   Pentafluoro(trifluoromethyl)sulfur; Trifluoromethylsulfur pentafluoride
76197 C3F8 perfluoropropane InChI=1S/C3F8/c4-1(5,2(6,7)8)3(9,10)11 QYSGYZVSCZSLHT-UHFFFAOYSA-N FC(F)(F)C(F)(F)C(F)(F)F   Octafluoropropane; Propane, octafluoro-; Freon 218; Genetron 218; perfluoropropane
13463406 Fe(CO)5 Iron pentacarbonyl InChI=1S/5CO.Fe/c5*1-2; FYOFOKCECDGJBF-UHFFFAOYSA-N O#C[Fe](C#O)(C#O)(C#O)C#O   Iron carbonyl; Pentacarbonyl iron
13463406 Fe(CO)5 Iron pentacarbonyl InChI=1S/5CO.Fe/c5*1-2; FYOFOKCECDGJBF-UHFFFAOYSA-N O#C[Fe](C#O)(C#O)(C#O)C#O   Iron carbonyl; Pentacarbonyl iron
102545 Fe(C5H5)2 ferrocene InChI=1S/2C5H5.Fe/c2*1-2-4-5-3-1;/h2*1-5H; DFRHTHSZMBROSH-UHFFFAOYSA-N [cH-]1cccc1.[cH-]1cccc1.[Fe+2]   Bis(?-cyclopentadienyl) iron
102545 Fe(C5H5)2 ferrocene InChI=1S/2C5H5.Fe/c2*1-2-4-5-3-1;/h2*1-5H; DFRHTHSZMBROSH-UHFFFAOYSA-N [cH-]1cccc1.[cH-]1cccc1.[Fe+2]   Bis(?-cyclopentadienyl) iron
208968 C12H8 Acenaphthylene InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H HXGDTGSAIMULJN-UHFFFAOYSA-N C12=C3C=CC=C1C=CC=C2C=C3   Acenaphthalene; Cyclopenta[de]naphthalene
259790 C12H8 biphenylene InChI=1S/C12H8/c1-2-6-10-9(5-1)11-7-3-4-8-12(10)11/h1-8H IFVTZJHWGZSXFD-UHFFFAOYSA-N C12=C(C=CC=C2)C3=CC=CC=C13   Cyclobutadibenzene; Diphenylene; 1,1'-Biphenylene; Dibenzocyclobutadiene; biphenylene
257249 C12H10 Heptalene InChI=1S/C12H10/c1-3-7-11-9-5-2-6-10-12(11)8-4-1/h1-10H DDTGNKBZWQHIEH-UHFFFAOYSA-N C12=CC=CC=CC1=CC=CC=C2   Bicyclo[5.5.0]dodecahexaene
92524 C12H10 biphenyl InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H ZUOUZKKEUPVFJK-UHFFFAOYSA-N C1(C2=CC=CC=C2)=CC=CC=C1   Bibenzene; Diphenyl; Phenylbenzene; 1,1'-Biphenyl; Lemonene
87898 C6H12O6 Inositol InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3+,4+,5-,6- CDAISMWEOUEBRE-CDRYSYESSA-N O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O   cyclohexane-1,2,3,4,5,6-hexol; scyllo-Inositol
392563 C6F6 hexafluorobenzene InChI=1S/C6F6/c7-1-2(8)4(10)6(12)5(11)3(1)9 ZQBFAOFFOQMSGJ-UHFFFAOYSA-N FC1=C(F)C(F)=C(F)C(F)=C1F   Benzene, hexafluoro-; perfluorobenzene
120127 C14H10 Anthracene InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H MWPLVEDNUUSJAV-UHFFFAOYSA-N C12=CC=CC=C1C=C3C(C=CC=C3)=C2   Anthracin; Paranaphthalene; Anthracen; Anthracene
85018 C14H10 Phenanthrene InChI=1S/C14H10/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-10H YNPNZTXNASCQKK-UHFFFAOYSA-N C12=CC=CC=C1C(C=CC=C3)=C3C=C2  
103333 C12H10N2 azobenzene InChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+ DMLAVOWQYNRWNQ-BUHFOSPRSA-N C1(/N=N/C2=CC=CC=C2)=CC=CC=C1   Diazene, diphenyl-; Azobenzide; Azobenzol; Benzene, azobis-; Benzene, azodi-; Benzeneazobenzene; Diazobenzene; Diphenyldiimide; 1,2-Diphenyldiazene; E-1,2-Diphenyldiazene; Azobisbenzene; Diphenyldiazene
129000 C16H10 Pyrene InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H BBEAQIROQSPTKN-UHFFFAOYSA-N C1(C=CC2=CC=C3)=CC=CC4=CC=C3C2=C14  
191071 C24H12 Coronene InChI=1S/C24H12/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19/h1-12H VPUGDVKSAQVFFS-UHFFFAOYSA-N c1cc2ccc3ccc4ccc5ccc6ccc1c7c2c3c4c5c67   Hexabenzobenzene; Dibenzo(ghi,pqr)perylene
99685968 C60 Buckminsterfullerene InChI=1S/C60/c1-2-5-6-3(1)8-12-10-4(1)9-11-7(2)17-21-13(5)23-24-14(6)22-18(8)28-20(12)30-26-16(10)15(9)25-29-19(11)27(17)37-41-31(21)33(23)43-44-34(24)32(22)42-38(28)48-40(30)46-36(26)35(25)45-39(29)47(37)55-49(41)51(43)57-52(44)50(42)56(48)59-54(46)53(45 XMWRBQBLMFGWIX-UHFFFAOYSA-N C1(C2=C34)=C5C6=C7C(C8=C9C%10=C%11C(C%12=C%13%14)=C%15%16)=C%11C%15=C6C1=C%17C%16=C%13C(C%18=C%19C%14=C%20C%12=C%10C(C%21=C%20C(C%22=C%21%23)=C%19%24)=C9C%25=C%23C%26=C%27C%22=C%28C%24=C%29%18)=C%17C2=C%29C4=C%28C%27=C%30C3=C5C%31=C%30C%26=C%25C8=C7%31