Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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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

casno	formula	name	InChI	InChIkey	SMILES	sketch	other names
12385136	H-	Hydrogen atom anion	InChI=1S/H/q-1	KLGZELKXQMTEMM-UHFFFAOYSA-N	[H-]	H-	hydride
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
7782390	D2	Deuterium diatomic	InChI=1S/H2/h1H/i1+1D	UFHFLCQGNIYNRP-VVKOMZTBSA-N	[2H][2H]		Deuterium; diduterium
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; dihydrogen
1333740	H2+	Hydrogen cation	InChI=1S/H2/h1H/q+1	ZZIJOQHRUPVPQC-UHFFFAOYSA-N	[H][H+]
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	Helium
7440597	He+	Helium atom cation	InChI=1S/He/q+1	QLNXTEZOQCZJBA-UHFFFAOYSA-N	[He+]	He+
9000184	He2+	helium diatomic 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
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)
7580678	LiH+	lithium hydride cation	InChI=1S/Li.H/q+1;	HSOYNNFNUCWPIZ-UHFFFAOYSA-N	[LiH+]
12162151	HeLi+	Helium Lithium cation	InChI=1S/He.Li/q;+1		[Li+][He]
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
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+]
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	RPHDAPRHVMJYOJ-UHFFFAOYSA-N	[BH4]
16971292	BH4	borohydride	InChI=1S/BH4/h1H4	RPHDAPRHVMJYOJ-UHFFFAOYSA-N	[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-]		methanide
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+]
676802	CHD3	methane-d3	InChI=1S/CH4/h1H4/i1D3	VNWKTOKETHGBQD-FIBGUPNXSA-N	C
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
74828	CH4-	Methane anion	InChI=1S/CH4/h1H4/q-1		[CH4-]
74828	CH4	Methane	InChI=1S/CH4/h1H4	VNWKTOKETHGBQD-UHFFFAOYSA-N	C		Biogas; Fire damp; Marsh gas; Methane; Methyl hydride; R 50
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+]
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+]
13770406	NH2-	amino anion	InChI=1S/H2N/h1H2/q-1	HYGWNUKOUCZBND-UHFFFAOYSA-N	[NH2-]		amide
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+]
15117847	ND2	Amidogen-d2	InChI=1S/H2N/h1H2/i1D2	MDFFNEOEWAXZRQ-DICFDUPASA-N	[N]([2H])[2H]		Amidogen-D2
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	TZXQEDWSXMUPRS-UHFFFAOYSA-N	[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 radical	InChI=1S/H4N/h1H4		[NH4]		Nitrogen tetrahydride
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
3352576	OH+	hydoxyl cation	InChI=1S/HO/h1H/q+1	MSCUNRCIQGLERU-UHFFFAOYSA-N	[OH+]
14940637	HDO	Water-d1	InChI=1S/H2O/h1H2/i/hD	XLYOFNOQVPJJNP-DYCDLGHISA-N	O[2H]		Water-D1
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+]
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
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-	fluoride
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; Fluoric acid; Fluorowodor; Fluorwasserstoff; Fluorwaterstof; Hydrofluoric acid; Hydrofluoride; Hydrogen fluoride; Rubigine
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	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
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)
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
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	[MgH-]
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; 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; 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
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+]
13780319	SiH2D2	silane-d2	InChI=1S/H4Si/h1H4		[SiH2D2]
7803625	SiH4	Silane	InChI=1S/H4Si/h1H4	BLRPTPMANUNPDV-UHFFFAOYSA-N	[SiH4]		Monosilane; Silane; Silicane; Silicon hydride; Silicon hydride (SiH4); Silicon tetrahydride
7803625	SiH4+	Silane cation	InChI=1S/H4Si/h1H4/q+1	WHUUBEIUVZVOTM-UHFFFAOYSA-N	[SiH4+]
165962107	SiH5+	Silane, protonated	InChI=1S/H5Si/h1H5/q+1		[SiH5+]
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
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; phosphane
7803512	PH3+	Phosphine cation	InChI=1S/H3P/h1H3/q+1	UTXZMINRCDLQKG-UHFFFAOYSA-N	[PH3+]
16749136	PH4	Phosphoranyl radical	InChI=1S/H4P/h1H4		[PH4]
16749136	PH4+	phosphonium cation	InChI=1S/H3P/h1H3/p+1	XYFCBTPGUUZFHI-UHFFFAOYSA-O	[PH4+]
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	Atomic sulfur; Brimstone; Flowers of sulfur; Sulfur; Sulfur atom
7704349	S+	Sulfur atom cation	InChI=1S/S/q+1	NKARKLBRYYSBBM-UHFFFAOYSA-N	[S+]	S+
13780239	DS	Mercapto-d	InChI=1S/HS/h1H/i1D	PXQLVRUNWNTZOS-MICDWDOJSA-N	[S][2H]		Mercapto-D
13940211	HS-	mercapto anion	InChI=1S/H2S/h1H2/p-1	RWSOTUBLDIXVET-UHFFFAOYSA-M	[SH-]		HS anion
13940211	HS	Mercapto radical	InChI=1S/HS/h1H	PXQLVRUNWNTZOS-UHFFFAOYSA-N	[SH]		Mercapto; Mercapto radical; Sulfanyl; λ1-Sulfane
13940211	HS+	sulfur monohydride cation	InChI=1S/HS/h1H/q+1	GSVBMMRCPHEJKN-UHFFFAOYSA-N	[SH+]
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; Schwefelwasserstoff; Siarkowodor; Stink damp; Sulfur hydride; Sulfureted hydrogen; Sulfuretted hydrogen; Zwavelwaterstof; Sulfane
7783064	H2S+	Hydrogen sulfide cation	InChI=1S/H2S/h1H2/q+1	PZLIRJTVVIBARZ-UHFFFAOYSA-N	[SH2+]
13536942	D2S	Hydrogen sulfide-d2	InChI=1S/H2S/h1H2/i/hD2	RWSOTUBLDIXVET-ZSJDYOACSA-N	S([2H])[2H]		Hydrogen sulfide-D2
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-	chloride
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; Basilin; Chlorohydric acid; Chlorwasserstoff; Hydrochloric Acid; Hydrochloric acid gas; Hydrochloride; Hydrogen chloride; Muriatic acid; NA 1789
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	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+]		argonium; argon, protonated
13939156	H2Ar	H2 Ar dimer	InChI=1S/ArH2/	XKRFYHLGVUSROY-UHFFFAOYSA-N	[ArH2]
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
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;	PMPBZPSFNVZWMY-UHFFFAOYSA-N	[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
7440622	V+	Vanadium atom cation	InChI=1S/V/q+1		[V+]	V+
7440473	Cr	Chromium atom	InChI=1S/Cr		[Cr]	Cr
13966795	CrH	Chromium hydride	InChI=1S/Cr.H		[CrH]		Chromium monohydride
13966795	CrH+	Chromium hydride cation	InChI=1S/Cr.H/q+1;		[CrH+]		Protonated Chromium
7439965	Mn	Manganese atom	InChI=1S/Mn		[Mn]	Mn
7439896	Fe	Iron atom	InChI=1S/Fe	XEEYBQQBJWHFJM-UHFFFAOYSA-N	[Fe]	Fe
7440484	Co	Cobalt atom	InChI=1S/Co		[Co]	Co
7440020	Ni	Nickel atom	InChI=1S/Ni		[Ni]	Ni
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]
13981878	ZnH+	Zinc, protonated	InChI=1S/Zn.H/q+1;		[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;	PIBWUQQSMYRAAW-UHFFFAOYSA-N	[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	VBLCRKLUGXNPLU-UHFFFAOYSA-N	[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+]
53250401	AsH4+	Arsonium	InChI=1S/AsH4/h1H4/q+1		[AsH4+]
7784421	AsH3	Arsine	InChI=1S/AsH3/h1H3	RBFQJDQYXXHULB-UHFFFAOYSA-N	[AsH3]		Arsenic trihydride; Arsenic hydride; Arsenous hydride; Hydrogen arsenide; 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]		selane
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	SPVXKVOXSXTJOY-UHFFFAOYSA-O	[SeH3+]		Selenonium
10097322	Br-	Bromine atom anion	InChI=1S/BrH/h1H/p-1	CPELXLSAUQHCOX-UHFFFAOYSA-M	[Br-]	Br-	bromide
10097322	Br	Bromine atom	InChI=1S/Br	WKBOTKDWSSQWDR-UHFFFAOYSA-N	[Br]	Br	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	WNNBBVLEFUBNE-UHFFFAOYSA-N	[BrH2+]
7439909	Kr	Krypton atom	InChI=1S/Kr	DNNSSWSSYDEUBZ-UHFFFAOYSA-N	[Kr]	Kr	Krypton
7439909	Kr+	Krypton cation	InChI=1S/Kr/q+1		[Kr+]	Kr+
75775529	KrH+	Protonated Krypton	InChI=1S/KrH/h1H/q+1	YDDYRYFCLMHJOO-UHFFFAOYSA-N	[KrH+]		Krypton hydrogen cation
7440315	Sn	Tin atom	InChI=1S/Sn	ATJFFYVFTNAWJD-UHFFFAOYSA-N	[Sn]	Sn
7440315	Sn+	Tin cation	InChI=1S/Sn/q+1		[Sn+]	Sn+
2406522	SnH4	Stannane	InChI=1S/Sn.4H		[SnH4]		Tin tetrahydride
7440360	Sb	Antimony atom	InChI=1S/Sb	WATWJIUSRGPENY-UHFFFAOYSA-N	[Sb]	Sb	Stibnum
13940357	SbH	Antimony monohydride	InChI=1S/Sb.H		[SbH]		Stibylene
7803523	SbH3	Stibine	InChI=1S/Sb.3H		[SbH3]		Antimony trihydride; Hydrogen antimonide
13494809	Te	Tellurium atom	InChI=1S/Te	PORWMNRCUJJQNO-UHFFFAOYSA-N	[Te]	Te
13494809	Te+	Tellurium atom cation	InChI=1S/Te/q+1		[Te+]	Te+
13940368	TeH	Telluryl radical	InChI=1S/HTe/h1H		[TeH]		Tellurium monohydride
7783097	H2Te	Hydrogen Telluride	InChI=1S/H2Te/h1H2	VTLHPSMQDDEFRU-UHFFFAOYSA-N	Te		dihydrogen telluride
14362448	I-	Iodine atom anion	InChI=1S/HI/h1H/p-1	XMBWDFGMSWQBCA-UHFFFAOYSA-M	[I-]	I-	Iodide
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
10034852	HI+	Hydrogen iodide cation	InChI=1S/HI/h1H/q+1		[IH+]
312602429	H2I+	Iodonium	InChI=1S/H2I/h1H2/q+1		[IH2+]
7440633	Xe	Xenon atom	InChI=1S/Xe	FHNFHKCVQCLJFQ-UHFFFAOYSA-N	[Xe]	Xe
37276918	XeH+	Xenon, protonated	InChI=1S/XeH/h1H/q+1		[XeH+]
14452596	Li2-	lithium diatomic 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 diatomic 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]
12523567	LiB	Lithium boride	InChI=1S/B.Li	PPTSBERGOGHCHC-UHFFFAOYSA-N	[Li][B]		Lithium monoboride
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]
57679637	BeB	Beryllium monoboride	InChI=1S/B.Be	IIAHSYIVJGROSB-UHFFFAOYSA-N	[Be][B]		Beryllium boride
56125747	HBBH	Diborane(2)	InChI=1S/B2H2/c1-2/h1-2H		B=B
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	B.B
19287457	B2H6	Diborane	InChI=1S/B2H6/c1-3-2-4-1/h1-2H2	KLDBIFITUCWVCC-UHFFFAOYSA-N	[BH2]1[H][BH2][H]1		Boron hydride; Diboron hexahydride; Boroethane
19287457	B2H6+	Diborane cation	inchi
57788939	LiC	Lithium Carbide	InChI=1S/C.Li	YZSKZXUDGLALTQ-UHFFFAOYSA-N	[Li][C]
57788940	BeC	Beryllium Carbide	InChI=1S/C.Be	XBJYWZKBHDUHGE-UHFFFAOYSA-N	[Be][C]
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]
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 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	H2CC-	vinylidene anion	InChI=1S/C2H2/c1-2/h1H2/q-1		[CH2][C-]
2143693	CCH2	vinylidene	InChI=1S/C2H2/c1-2/h1H2	SNVLJLYUUXKWOJ-UHFFFAOYSA-N	[C]=C
74862	HCCH-	acetylene anion	InChI=1S/C2H2/c1-2/h1-2H/q-1		[CH][CH-]
74862	HCCH-	acetylene anion	InChI=1S/C2H2/c1-2/h1-2H/q-1		[CH][CH-]
74862	C2H2	Acetylene	InChI=1S/C2H2/c1-2/h1-2H	HSFWRNGVRCDJHI-UHFFFAOYSA-N	C#C		Acetylen; Acetylene; Ethine; Ethyne; Narcylen; Vinylene
74862	C2H2+	acetylene cation	InChI=1S/C2H2/c1-2/h1-2H/q+1	GWUDYHMQOUXMQT-UHFFFAOYSA-N	[CH]=[CH+]
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	IEARPTNIYZTWOZ-UHFFFAOYSA-N	[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	DJWFTFKVJARRDX-UHFFFAOYSA-N	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
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
12538964	CH3BH2	methylborane	InChI=1S/CH5B/c1-2/h2H2,1H3	PLFLRQISROSEIJ-UHFFFAOYSA-N	CB		borane, methyl-
74840	C2H6	Ethane	InChI=1S/C2H6/c1-2/h1-2H3	OTMSDBZUPAUEDD-UHFFFAOYSA-N	CC		Bimethyl; Dimethyl; Ethane; Ethyl hydride; Methylmethane
74840	C2H6	Ethane	InChI=1S/C2H6/c1-2/h1-2H3	OTMSDBZUPAUEDD-UHFFFAOYSA-N	CC		Bimethyl; Dimethyl; Ethane; Ethyl hydride; Methylmethane
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	C.C		ethanium cation
9000381	C2H7+	Ethane, protonated	InChI=1S/C2H7/c1-3-2/h1-2H3/q+1	UQJIDEGGAKZKSY-UHFFFAOYSA-N	NULL		ethanium cation
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
7727379	N2+	diatomic nitrogen cation	InChI=1S/N2/c1-2/q+1	OCLMUTJUZGFVFC-UHFFFAOYSA-N	[N+]#N
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]
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]
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]
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
2074875	CN+	Cyano cation	InChI=1S/CN/c1-2/q+1	NKCCODPFBDGPRJ-UHFFFAOYSA-N	[C+]#N
6914074	HNC	hydrogen isocyanide	InChI=1S/CHN/c1-2/h2H	QIUBLANJVAOHHY-UHFFFAOYSA-N	[NH+]#[C-]
6914074	HNC+	hydrogen isocyanide cation	InChI=1S/CHN/c1-2/h2H/q+1		[C]=[NH+]
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; Zaclondiscoids
74908	HCN+	hydrogen cyanide cation	InChI=1S/CHN/c1-2/h1H/q+1	JUQAVPCSDMFGHW-UHFFFAOYSA-N	[CH+][N]
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
40493810	HNB	hydrogen nitrogen boron	InChI=1S/BHN/c1-2/h2H	XIUTTYIRABRWRB-UHFFFAOYSA-N	[NH][B]
54980119	HCNH	methyleneazane	InChI=1S/CH2N/c1-2/h1-2H	GNMFKYYLBRTFHL-UHFFFAOYSA-N	[CH]=N
54980119	HCNH	methyleneazane	InChI=1S/CH2N/c1-2/h1-2H	GNMFKYYLBRTFHL-UHFFFAOYSA-N	[CH]=N
54980119	HCNH+	N-protonated HCN	InChI=1S/CH2N/c1-2/h1-2H/q+1	DCMJLVFIGUTGGQ-UHFFFAOYSA-N	[CH][NH+]
28647383	H2NN	Isodiazene	InChI=1S/H2N2/c1-2/h1H2/		[NH2]=[N]
28647383	H2NN	Isodiazene	InChI=1S/H2N2/c1-2/h1H2		[NH2+][N-]
15119978	HBNH	Boranimine	InChI=1S/BH2N/c1-2/h1-2H	LNLSXDSWJBUPHM-UHFFFAOYSA-N	B=N		Borane, imino-; Iminoborane
15626423	N2H2	(Z)-Diazene	InChI=1S/H2N2/c1-2/h1-2H/b2-1-	RAABOESOVLLHRU-UPHRSURJSA-N	N=N		cis-diazine
15626423	N2H2	(Z)-Diazene	InChI=1S/H2N2/c1-2/h1-2H	RAABOESOVLLHRU-UHFFFAOYSA-N	N=N		cis-diazine
15626434	N2H2	(E)-diazene	InChI=1S/H2N2/c1-2/h1-2H/b2-1+	RAABOESOVLLHRU-OWOJBTEDSA-N	N=N		(E)-Diazene; E-diazine; t-diazine; diazine; trans-diazine
15626434	N2H2+	trans-diazene cation	InChI=1S/H2N2/c1-2/h1-2H/q+1	UGMYJEUXIMNOHA-UHFFFAOYSA-N	N=[NH+]		59952-06-6
7782890	LiNH2	lithium amide	InChI=1S/Li.H2N/h;1H2/q+1;-1		[Li]N		Lithamide
9000286	H2CN	Dihydrogen cyanide radical	InChI=1S/CH2N/c1-2/h1H2	PZIDJKOIMRBQLL-UHFFFAOYSA-N	C=[N]		Amidogen, methylene-; Methyleneimino radical; Methyleneamidogen
9000286	H2CN+	hydrocyanonium cation	InChI=1S/CH2N/c1-2/h1H2/q+1	MKPAEABOTWWIBE-UHFFFAOYSA-N	[CH2+][N]		protonated hydrogen cyanide; hydrocyanonium
9000317	CNH2	Aminomethylidyne radical	InChI=1S/CH2N/c1-2/h2H2	OGBYLFXCCAHRHC-UHFFFAOYSA-N	[C]N
9000317	CNH2+	N-protonated hydrogen isocyanide	InChI=1S/CH2N/c1-2/h2H2/q+1	RYMZMJIGPPIVIV-UHFFFAOYSA-N	[C]=[NH2+]
35430172	CHNH2	aminomethylene	InChI=1S/CH3N/c1-2/h1H,2H2		[CH]N		aminocarbene
35430172	CHNH2+	Aminocarbene cation	InChI=1S/CH3N/c1-2/h1H,2H2/q+1		[CH]=[NH2+]
2053294	CH2NH	Methanimine	InChI=1S/CH3N/c1-2/h2H,1H2	WDWDWGRYHDPSDS-UHFFFAOYSA-N	C=N		Methanimine; Methyleneimine
2053294	CH2NH+	Methanimine cation	InChI=1S/CH3N/c1-2/h2H,1H2/q+1		[CH2+][NH]
302012	N2H4	Hydrazine	InChI=1S/H4N2/c1-2/h1-2H2	OAKJQQAXSVQMHS-UHFFFAOYSA-N	NN		Diamide; Diamide hydrate; Diamine; Hydrazine; Hydrazine, anhydrous; Hydrazyna; Levoxine
302012	N2H4+	hydrazine cation	InChI=1S/H4N2/c1-2/h1-2H2/q+1	HWDYJVUNTFRESF-UHFFFAOYSA-N	[NH2+]N
14720355	BH2NH2	Boranamine	InChI=1S/BH4N/c1-2/h1-2H2	KKAXNAVSOBXHTE-UHFFFAOYSA-N	BN
10507296	CH2NH2+	methyleneamine cation	InChI=1S/CH4N/c1-2/h1-2H2/q+1	LEOYJZAFSUBIBE-UHFFFAOYSA-N	[CH2+]N		aminomethylium; iminomethylium
10507296	CH2NH2+	methyleneamine cation	InChI=1S/CH3N/c1-2/h2H,1H2/p+1	WDWDWGRYHDPSDS-UHFFFAOYSA-O	C=[NH2+]		aminomethylium; iminomethylium
18500328	N2H5+	protonated hydrazine	InChI=1S/H4N2/c1-2/h1-2H2/p+1	OAKJQQAXSVQMHS-UHFFFAOYSA-O	[NH3+]N
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
74895	CH3NH2+	methyl amine cation	InChI=1S/CH5N/c1-2/h2H2,1H3/q+1	BAVYZALUXZFZLV-UHFFFAOYSA-N	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
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+]		methylammonium
13774817	BH3NH3	borane ammonia	InChI=1S/BH6N/c1-2/h1-2H3	PJYXJGDRFASJSB-UHFFFAOYSA-N	[BH3-][NH3+]
56044485	N2H7+	ammonia ammonium dimer	InChI=1S/H4N.H3N/h1H4;1H3/p+1		N.[NH4+]		protonated ammonia dimer
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
7782447	O2--	dioxygen dianion	InChI=1S/O2/c1-2/q-2		[O-][O-]		peroxide; Oxygen molecule dianion
7782447	O2-	oxygen diatomic anion	InChI=1S/HO2/c1-2/h1H/p-1	OUUQCZGPVNCOIJ-UHFFFAOYSA-M	[O-][O]		oxygen anion; superoxide
7782447	O2	Oxygen diatomic	InChI=1S/O2/c1-2	MYMOFIZGZYHOMD-UHFFFAOYSA-N	O=O		Dioxygen; Molecular oxygen; Oxygen; Oxygen molecule; Oxygen-16
7782447	O2+	diatomic oxygen cation	InChI=1S/O2/c1-2/q+1	KMHJKRGRIJONSV-UHFFFAOYSA-N	[O+]=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]
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 oxide; Carbon oxide (CO); Carbone; Carbonic oxide; Carbonio; Kohlenmonoxid; Kohlenoxyd; Koolmonoxyde; Monoxide; NA 9202; Oxyde de carbone
630080	CO+	carbon monoxide cation	InChI=1S/CO/c1-2/q+1	BOJPITGAFFYFJK-UHFFFAOYSA-N	[C+]=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
2597446	HCO-	formyl anion	InChI=1S/CHO/c1-2/h1H/q-1	CKJNUZNMWOVDFN-UHFFFAOYSA-N	[CH-]=O		formate
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
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	O=[OH+]
3170830	HO2+	Hydroperoxy cation	InChI=1S/O2/c1-2/p+1	MYMOFIZGZYHOMD-UHFFFAOYSA-O	NULL
35337598	NOH	Hydroxyimidogen	InChI=1S/HNO/c1-2/h2H	JSGZKHJWRITPII-UHFFFAOYSA-N	[N]O		Hydroxyimino; Hydroxynitrene
35337598	NOH+	O-protonated nitric oxide	InChI=1S/HNO/c1-2/h2H/q+1	MWUXSHHQAYIFBG-UHFFFAOYSA-O	[N]=[OH+]
71080927	COH	Hydroxymethylidyne	InChI=1S/CHO/c1-2/h2H		[C]O		Methylidyne, hydroxy-; isoformyl radical
71080927	COH+	Carbon Monoxide, protonated	InChI=1S/CHO/c1-2/h2H/q+1	FIRPXVMETWVPCB-UHFFFAOYSA-N	[C]=[OH+]
20611590	HBO	Boron hydride oxide	InChI=1S/BHO/c1-2/h1H	UXUFOKFTFHRQTE-UHFFFAOYSA-N	B=O		Boron hydride oxide; oxoborane
20768687	BeOH	beryllium monohydroxide	InChI=1S/Be.H2O/h;1H2/q+1;/p-1	XTIMETPJOMYPHC-UHFFFAOYSA-M	[Be]O		BeOH; Beryllium hydroxide
20768687	BeOH	beryllium monohydroxide	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
7722841	H2O2	Hydrogen peroxide	InChI=1S/H2O2/c1-2/h1-2H	MHAJPDPJQMAIIY-UHFFFAOYSA-N	OO		Dihydrogen dioxide; Elawox; Hydrogen dioxide; Hydrogen oxide; Hydrogen peroxide (H2O2); Perhydrol; Perossido di idrogeno; Peroxaan; Peroxyde d'hydrogene; Superoxol; T-Stuff; Waterstofperoxyde; 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 (H2O2); Perhydrol; Perossido di idrogeno; Peroxaan; Peroxyde d'hydrogene; Superoxol; T-Stuff; Waterstofperoxyde; 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+]
13408292	H2NO	nitroxide	InChI=1S/H2NO/c1-2/h1H2	YLFIGGHWWPSIEG-UHFFFAOYSA-N	[NH2]=O
50000	H2CO-	formaldehyde anion	InChI=1S/CH2O/c1-2/h1H2/q-1	RCQZCQSUQBQDGR-UHFFFAOYSA-N	C=[O-]
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		Formaldehyde; Formic aldehyde; Formol; Methaldehyde; Methanal; Methyl aldehyde; Methylene glycol; Methylene oxide
50000	H2CO+	formaldehyde cation	InChI=1S/CH2O/c1-2/h1H2/q+1	SAJCHROCEMQFHF-UHFFFAOYSA-N	C=[O+]
171363090	H2OO	water oxide	InChI=1S/H2O2/c1-2/h1H2		[OH2+][O-]
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		protonated formaldehyde
2143682	CH3O-	methoxy anion	InChI=1S/CH3O/c1-2/h1H3/q-1	NBTOZLQBSIZIKS-UHFFFAOYSA-N	C[O-]		methoxide; methanolate
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	DNYFZVYVKGRENU-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	O[OH2+]
7803498	NH2OH	hydroxylamine	InChI=1S/H3NO/c1-2/h2H,1H2	AVXURJPOCDRRFD-UHFFFAOYSA-N	NO		Oxammonium; hydroxylamine
7803498	NH2OH+	Hydroxylamine cation	InChI=1S/H3NO/c1-2/h2H,1H2/q+1		[NH2+]=[OH]
38544488	NH3O	Ammonia Oxide	InChI=1S/H3NO/c1-2/h1H3	GSWAOPJLTADLTN-UHFFFAOYSA-N	[NH3+][O-]		azane oxide
20712838	NH3OH+	N-protonated hydroxylamine	InChI=1S/H4NO/c1-2/h2H,1H3/q+1		[NH3+]O		Aminooxonium; Hydroxyammonium cation; Hydroxylammonium
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; Wood alcohol; 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+]
323194327	NH2OH2+	protonated hydroxylamine	InChI=1S/H3NO/c1-2/h2H,1H2/p+1		N[OH2+]
33	H2ONH3	Water Ammonia Dimer	InChI=1S/H5NO/c1-3-2/h2H,1H3	SPYQWCOYCDNQJZ-UHFFFAOYSA-N	N.O
22206742	H5O2+	Dihydroxonium ion	InChI=1S/2H2O/h2*1H2/p+1	YBSGOCLVQAVBDW-UHFFFAOYSA-N	[OH3+].[OH2]		Diaquahydrogen ion; Zundel cation
9000371	CH3OH2+	Methanol, protonated	InChI=1S/CH4O/c1-2/h2H,1H3/p+1	OKKJLVBELUTLKV-UHFFFAOYSA-O	C[OH2+]
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
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; Saeure fluoride; difluorine
7782414	F2+	flourine diatomic cation	InChI=1S/F2/c1-2/q+1	PCZTVBPMAMPCIP-UHFFFAOYSA-N	[F+]F
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
14034798	HOF	Hypofluorous acid	InChI=1S/FHO/c1-2/h2H	AQYSYJUIMQTRMV-UHFFFAOYSA-N	FO		Hypofluorous acid
18130740	FHF-	Hydrogen difluoride anion	InChI=1S/F2H/c1-3-2/q-1	LJRMFMQHZAVYNS-UHFFFAOYSA-N	F.F		Hydrogen difluoride anion
18130740	FHF	Hydrogen difluoride	InChI=1S/2FH/h2*1H	CUPFNGOKRMWUOO-UHFFFAOYSA-N	F.F
13453526	HCF	Fluoromethylene	InChI=1S/CHF/c1-2/h1H	YUCFVHQCAFKDQG-UHFFFAOYSA-N	[CH]F		Fluoromethylene
9000919	F2H+	Fluorine, protonated	InChI=1S/F2H/c1-2/h1H/q+1	RKUNWRMJYQSYIK-UHFFFAOYSA-N	F[FH+]
30664121	H2F2	Hydrogen fluoride dimer	InChI=1S/F2H2/c1-3-2/h1H	WGRFAFFYKGIUGZ-UHFFFAOYSA-N	F.F		Hydrogen fluoride dimer
15861059	NH2F	monofluoroamine	InChI=1S/FH2N/c1-2/h2H2	MDQRDWAGHRLBPA-UHFFFAOYSA-N	NF		Monofluoroammonia; Fluoroamine
3744294	CH2F	fluoromethyl radical	InChI=1S/CH2F/c1-2/h1H2	VUWZPRWSIVNGKG-UHFFFAOYSA-N	[CH2]F		Methyl, fluoro-; Methyl radical, fluoro-
3744294	CH2F+	fluoromethyl cation	InChI=1S/CH2F/c1-2/h1H2/q+1		[CH2+]F		Fluoromethylium
558214	CD3F	methylfluoride-d3	InChI=1S/CH3F/c1-2/h1H3/i1D3	NBVXSUQYWXRMNV-FIBGUPNXSA-N	CF		Fluoromethane-d3
593533	CH3F	Methyl fluoride	InChI=1S/CH3F/c1-2/h1H3	NBVXSUQYWXRMNV-UHFFFAOYSA-N	CF		Fluoromethane; Freon 41; Methane, fluoro-; Methyl fluoride
593533	CH3F+	methyl fluoride cation	InChI=1S/CH3F/c1-2/h1H3/q+1		[CH3+]F
12521470	LiNe+	Lithium Neon cation	InChI=1S/Li.Ne/q+1;		[Li+][Ne]
12185056	Ne2	Neon diatomic	InChI=1S/Ne2/c1-2	AOYLJFJXTMPVQU-UHFFFAOYSA-N	[Ne][Ne]
12185056	Ne2+	Neon diatomic 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	[Li][Na]
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	[Li][Na+]
25681792	Na2-	sodium diatomic anion	InChI=1S/2Na/q;-1	BNGLLXLLJXMLTN-UHFFFAOYSA-N	[Na]=[Na-]
25681792	Na2-	sodium diatomic 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 diatomic cation	InChI=1S/2Na/q;+1	YWCMJCGHOWDIIZ-UHFFFAOYSA-N	[Na][Na+]
25681792	Na2+	sodium diatomic 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	[Be][Na]
12401864	NaO-	sodium oxide anion	InChI=1S/Na.O/q;-1	BDJROSQLJNXSHE-UHFFFAOYSA-N	[O-].[Na]
12401864	NaO-	sodium oxide anion	InChI=1/Na.O/q;-1/rNaO/c1-2/q-1	BDJROSQLJNXSHE-CRUIXLRBNA-N	[O-].[Na] [O-][Na]
12401864	NaO	sodium monoxide	InChI=1S/Na.O	IVAOQJNBYYIDSI-UHFFFAOYSA-N	[Na][O]		Calcined soda; Sodium monoxide; Sodium oxide
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	O=[Na+]
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		Fluoride, sodium; Sodium Fluoride; Sodium monofluoride; 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	[Na][Mg]
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	[Li][Mg]
29904798	Mg2-	magnesium diatomic anion	InChI=1S/2Mg/q;-1	CISLHUYDBIYHAP-UHFFFAOYSA-N	[Mg]#[Mg-]
29904798	Mg2-	magnesium diatomic 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 diatomic cation	InChI=1S/2Mg/q;+1	HRLTYPKXXQLYKW-UHFFFAOYSA-N	[Mg][Mg+]
29904798	Mg2+	magnesium diatomic cation	InChI=1/2Mg/q;+1/rMg2/c1-2/q+1	HRLTYPKXXQLYKW-SNICHUAKNA-N	[Mg][Mg+]
81099061	BeMg	Beryllium Magnesium	InChI=1S/Be.Mg	UEFUYLGMYTWGJW-UHFFFAOYSA-N	[Be][Mg]
60195155	MgN	Magnesium Nitride	InChI=1S/Mg.N		[Mg][N]
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	[O-][Mg]
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=1S/Mg.H2O/h;1H2/q+1;/p-1	UNYOJUYSNFGNDV-UHFFFAOYSA-M	[OH-].[Mg+]		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
39422247	NaAl	Sodium aluminum	InChI=1S/Al.Na		[Na][Al]
32752946	Al2-	aluminum diatomic anion	InChI=1S/2Al/q;-1	IDPICEGAWIXDJU-UHFFFAOYSA-N	[Al]#[Al-]
32752946	Al2-	aluminum diatomic 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 diatomic cation	InChI=1S/2Al/q;+1	FTMHZEODMLVFLK-UHFFFAOYSA-N	[Al]=[Al+]
12042374	LiAl	Lithium Aluminum	InChI=1S/Al.Li		[Li][Al]
12250429	BAl	Boron Aluminum	InChI=1S/Al.B	OLPJLZLFBXJWKN-UHFFFAOYSA-N	[B][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]
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	[Al][F-]
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	[Al+]F
12589025	BSi	Boron silicide	InChI=1S/BSi/c1-2		[B]=[Si]		Boron Silicon diatomic
12597352	Si2-	silcon diatomic 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 diatomic 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+]
36835582	Si2H2	disilyne	InChI=1S/H2Si2/c1-2/h1-2H		[SiH]#[SiH]		disilicon dihydride
36835582	Si2H2	disilyne	InChI=1S/H2Si2/c1-2/h1-2H		[SiH]=[SiH]		disilicon dihydride
36835582	Si2H2	disilyne	InChI=1S/H4Si2/c1-2/h1-2H		[SiH2][SiH2]		disilicon dihydride
36835582	Si2H2	disilyne	InChI=1S/H4Si2/c1-2/h1-2H		[Si]1H[SiH]1		disilicon dihydride
51067846	CH2SiH2	silaethylene	InChI=1S/CH4Si/c1-2/h1-2H2	CBZNDCXNWNCBHK-UHFFFAOYSA-N	C=Si
15435775	Si2H4	Disilene	InChI=1S/H4Si2/c1-2/h1-2H2		[SiH2]=[SiH2]		disilaethylene; disilylene
15435775	Si2H4	Disilene	InChI=1S/H4Si2/c1-2/h1-2H2		[SiH2]-[SiH2]		disilaethylene; disilylene
15435775	Si2H4	Disilene	InChI=1S/H4Si2/c1-2/h1-2H2		[H]1[SiH]2[SiH]1[H]2		disilaethylene; disilylene
1590870	Si2H6	disilane	InChI=1S/H6Si2/c1-2/h1-2H3	PZPGRFITIJYNEJ-UHFFFAOYSA-N	[SiH3][SiH3]		Disilane; Silicoethane
992949	CH3SiH3	methyl silane	InChI=1S/CH6Si/c1-2/h1-2H3	UIUXUFNYAYAMOE-UHFFFAOYSA-N	[SiH3]C		Methylsilane; Silaethane; Silane, methyl-
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
13598782	SiH3NH2	Silane, amino	InChI=1S/H5NSi/c1-2/h1H2,2H3		[SiH3]N		Silanamine; Silylamine; Aminosilane; Silicyl amide
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+]
14475388	SiH3OH	silanol	InChI=1S/H4OSi/c1-2/h1H,2H3		[SiH3]O		Hydroxysilane
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+]
50561303	HSiF	fluorosilylene	InChI=1S/FHSi/c1-2/h2H		[SiH]F		silylene, fluoro-
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+]
12259482	LiP	Lithium monophosphide	InChI=1S/Li.P		[Li][P]
12185090	P2-	phosphorus diatomic 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(III) phosphide
12185090	P2+	phosphorus diatomic cation	InChI=1S/P2/c1-2/q+1	GSQBFINVLXKPNU-UHFFFAOYSA-N	P#[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+]
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+]
20859738	AlP	Aluminum monophosphide	InChI=1S/Al.P	PPNXXZIBFHTHDM-UHFFFAOYSA-N	[Al]#P
20205918	BP	Boron monophosphide	InChI=1S/BP/c1-2	FFBGYFUYJVKRNV-UHFFFAOYSA-N	B#P
13817066	HPO	Hydrogen phosphorus oxide	InChI=1S/HOP/c1-2/h1H	DMGNFLJBACZMRM-UHFFFAOYSA-N	P=O		Oxophosphine
13817066	HPO+	Hydrogen phosphorus oxide cation	InChI=1S/HOP/c1-2/h2H/q+1	LDPFQYNIASWZRM-UHFFFAOYSA-N	[PH+]=O
6829523	HCP	Phosphaethyne	InChI=1S/CHP/c1-2/h1H	DPYPSJGRRFKXBE-UHFFFAOYSA-N	C#P		CHP; Methinophosphide; Phosphaethyne; methylidynephosphine; Phosphine, methylidyne-
6829523	HCP+	Phosphaethyne cation	InChI=1S/CHP/c1-2/h1H/q+1		C#[P+]		Methinophosphide cation; Phosphaethyne radical cation
61183537	CH2PH	Phosphaethene	InChI=1S/CH3P/c1-2/h2H,1H2	HIQXJRBKNONWAH-UHFFFAOYSA-N	[CH2]=[PH]		Phosphaethene; methylenephosphane
13445506	P2H4	Diphosphine	InChI=1S/H4P2/c1-2/h1-2H2	VURFVHCLMJOLKN-UHFFFAOYSA-N	PP		Diphosphine; Biphosphine
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	SAWKFRBJGLMMES-UHFFFAOYSA-O	C[PH3+]		methylphophoranyl cation
19121563	BH3PH3	borane phosphine	InChI=1S/BH6P/c1-2/h1-2H3		[BH3-][PH3+]		Borane-phosphine (1:1); Boron, trihydro(phosphine)​-
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
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
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]
23550450	S2-	sulfur diatomic 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 diatomic cation	InChI=1S/S2/c1-2/q+1	YUWMVWRPXKPVMW-UHFFFAOYSA-N	S=[S+]
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+]
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
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+]
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
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+]
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+]
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
115694774	NaS	Sodium sulfide	InChI=1S/Na.S	BNOODXBBXFZASF-UHFFFAOYSA-N	[Na][S]
9000242	HNS-	Sulfur imide anion	InChI=1S/HNS/c1-2/h1H/q-1	LVAUBKGSZLNRAL-UHFFFAOYSA-N	[NH][S-]
9000242	HNS	Sulfur imide	InChI=1S/HNS/c1-2/h1H	GLBQVJGBPFPMMV-UHFFFAOYSA-N	N=S		Iminosulfur; Thionitroxyl
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
62470717	HSO+	Sulfur Monoxide, S-protonated	InChI=1S/HOS/c1-2/h2H/q+1		[SH+][O]
62803127	SOH	Sulfur Hydroxide	InChI=1S/HOS/c1-2/h1H		[S]O
62803127	SOH+	Sulfur Monoxide, protonated	InChI=1S/HOS/c1-2/h1H/q+1		[S+]O
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
62607447	HOSH	hydrogen thioperoxide	InChI=1S/H2OS/c1-2/h1-2H		SO
13465071	H2S2	Disulfane	InChI=1S/H2S2/c1-2/h1-2H	BWGNESOTFCXPMA-UHFFFAOYSA-N	SS		Dihydrogen disulfide
13465071	H2S2+	hydrogen disulfide cation	InChI=1S/H2S2/c1-2/h1-2H/q+1	JIQKIOAUHYCLRI-UHFFFAOYSA-N	S[SH+]
865361	H2CS-	thioformaldehyde anion	InChI=1S/CH2S/c1-2/h1H2/q-1		[S-][CH2]
865361	H2CS	Thioformaldehyde	InChI=1S/CH2S/c1-2/h1H2	DBTDEFJAFBUGPP-UHFFFAOYSA-N	C=S		Thioformaldehyde; methanethial
865361	H2CS+	thioformaldehyde cation	InChI=1S/CH2S/c1-2/h1H2/q+1	PITNAJWFZQWKRG-UHFFFAOYSA-N	C=[S+]
7175759	CH3S	thiomethoxy	InChI=1S/CH3S/c1-2/h1H3	QSLPNSWXUQHVLP-UHFFFAOYSA-N	C[S]		Methylthio radical
98402358	NH3S	sulfidoazane	InChI=1S/H3NS/c1-2/h1H3		[S-][NH3+]		Nitrogen hydride sulfide
20879509	H2CSH+	Thioformaldehyde, protonated	InChI=1S/CH2S/c1-2/h1H2/p+1	DBTDEFJAFBUGPP-UHFFFAOYSA-O	[SH+]=C
14097008	NH2SH	Thiohydroxylamine	InChI=1S/H3NS/c1-2/h2H,1H2		NS
14097008	NH2SH	Thiohydroxylamine	InChI=1S/H3NS/c1-2/h2H,1H2		NS
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; Thiomethanol
74931	CH3SH+	Methanethiol cation	InChI=1S/CH4S/c1-2/h2H,1H3/q+1	LSDPWZHWYPCBBB-UHFFFAOYSA-N	C[SH+]		53369-41-8
90827842	CH3SH2+	protonated methylsulfide	InChI=1S/CH4S/c1-2/h2H,1H3/p+1	LSDPWZHWYPCBBB-UHFFFAOYSA-O	C[SH2+]		Methyl mercaptan, protonated
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+]
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		hypochlorite
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+]
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
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	[Be-]Cl
13814501	BeCl	beryllium monochloride	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
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
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
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+]
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+]
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		Common salt; Halite; Hyposaline; Iodized salt; Natriumchlorid; Rock salt; Saline; Salt; Sea salt; Sodium chloric; Sodium Chloride; Sodium monochloride; Sterling; Table salt; USP sodium chloride
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+]
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; 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
7790923	HOCl+	hypochlorous acid cation	InChI=1S/ClHO/c1-2/h2H/q+1		O[Cl+]
12015406	Cl2H+	Chlorine, protonated	InChI=1S/Cl2H/c1-2/h1H/q+1	HUIKBYLIJHHEJA-UHFFFAOYSA-N	Cl[ClH+]
70110633	ClFH+	Chlorine fluoride, F-protonated	InChI=1S/ClFH/c1-2/h2H/q+1		Cl[FH+]		Fluorine(1+)​, chlorohydro-
70110644	FClH+	Chlorine fluoride, Cl-protonated	InChI=1S/ClFH/c1-2/h1H/q+1		F[ClH+]
13770224	DOCl	Hypochlorous acid-d	InChI=1S/ClHO/c1-2/h2H/i2D	QWPPOHNGKGFGJK-VMNATFBRSA-N	O(Cl)[2H]		DOCl; Hypochlorous acid-D
13931970	HSiCl	Chlorosilylene	InChI=1S/ClHSi/c1-2/h2H	DESGIDRJCLIWRS-UHFFFAOYSA-N	[SiH]Cl		Silylene, chloro-
10599903	NH2Cl	chloramine	InChI=1S/ClH2N/c1-2/h2H2	QDHHCQZDFGDHMP-UHFFFAOYSA-N	NCl		Chloramide; Chloroamine; Monochloramide; Monochloramine; Monochloroamine; Monochloroammonia
6806866	CH2Cl+	chloromethyl cation	InChI=1S/CH2Cl/c1-2/h1H2/q+1		[CH2+]Cl
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
74873	CH3Cl+	Methyl chloride cation	InChI=1S/CH3Cl/c1-2/h1H3/q+1		C[Cl+]
74873	CH3Cl+	Methyl chloride cation	InChI=1S/CH3Cl/c1-2/h1H3/q+1		C[Cl+]
74873	CH3Cl+	Methyl chloride cation	InChI=1S/CH3Cl/c1-2/h1H3/q+1		C[Cl+]
12432483	NH3Cl+	protonated monochloroammonia	InChI=1S/ClH2N/c1-2/h2H2/p+1		[NH3+]Cl		Ammoniumyl chloride; Ammoniumyl chloride cation
13465786	SiH3Cl	chlorosilane	InChI=1S/ClH3Si/c1-2/h2H3	KOPOQZFJUQMUML-UHFFFAOYSA-N	[SiH3]Cl		Chlorosilane; Silane, chloro-
12125029	NH4Cl	Ammonium chloride	InChI=1S/ClH.H3N/h1H;1H3	NLXLAEXVIDQMFP-UHFFFAOYSA-N	N.Cl
65967477	CH3ClH+	methyl chloride, protonated	InChI=1S/CH4Cl/c1-2/h2H,1H3/q+1		C[ClH+]		protonated methyl chloride
12595594	Ar2	Argon diatomic	InChI=1S/2Ar	XMPZLAQHPIBDSO-UHFFFAOYSA-N	[Ar][Ar]
12595594	Ar2+	Argon diatomic cation	InChI=1S/Ar2/c1-2/q+1	HTIFKSFRQRSNHN-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]
12056290	NaK+	Sodium Potassium diatomic cation	InChI=1S/K.Na.H/q+1;;	MNSZYVKTVLVSAF-UHFFFAOYSA-N	[Na].[K+]
25681805	K2	Potassium diatomic	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+]
1310583	KOH	Potassium hydroxide	InChI=1S/K.H2O/h;1H2/q+1;/p-1	KWYUFKZDYYNOTN-UHFFFAOYSA-M	[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 diatomic	InChI=1S/2Ca	CPGKMLVTFNUAHL-UHFFFAOYSA-N	[Ca][Ca]		dicalcium
65380769	CaC	Calcium monocarbide	InChI=1S/C.Ca/q-1;+1		[Ca+]#[C-]		Calcium carbide radical
20548543	CaS	Calcium sulfide	InChI=1S/Ca.S	JGIATAMCQXIDNZ-UHFFFAOYSA-N	[Ca]=S		calcium sulphide
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
13827264	CaF	Calcium monofluoride	InChI=1S/Ca.FH/h;1H/q+1;/p-1	PMJVACMPRFHIPZ-UHFFFAOYSA-M	[Ca]F
15606710	CaCl	calcium monochloride	InChI=1S/Ca.ClH/h;1H/q+1;/p-1	WGPMOVAPQPJDDK-UHFFFAOYSA-M	[Ca]Cl
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	PDBOLQCPEKXSBW-UHFFFAOYSA-M	[Ti]Cl
12035982	VO	Vanadium monoxide	InChI=1S/O.V	IBYSTTGVDIFUAY-UHFFFAOYSA-N	[V][O]
12190704	Cu2	Copper diatomic	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
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]
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
9000151	ZnCl	Zinc monochloride	InChI=1S/ClH.Zn/h1H;/q;+1/p-1	ZXYNGLRGFYLTQZ-UHFFFAOYSA-M	[Zn]Cl
39399558	AlGa	Aluminum Gallium	InChI=1S/Al.Ga		[Al][Ga]
39399558	AlGa	Aluminum Gallium	InChI=1S/Al.Ga.2H	DQTRTWKUTYAGKU-UHFFFAOYSA-N	[Al][Ga]
74508240	Ga2	Gallium diatomic	InChI=1S/2Ga	ZRGXNJBDGJRQMD-UHFFFAOYSA-N	[Ga][Ga]
1408277064	BGa	Boron Gallium	InChI=1S/B.Ga	RFZDQLXPTPBDCM-UHFFFAOYSA-N	[B][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
12063988	GaP	Gallium monophosphide	InChI=1S/Ga.P	KDNRAIADFXOCMW-UHFFFAOYSA-N	[Ga]#P		Gallium phosphide
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
12024101	GaS	Gallium monosulfide	InChI=1S/Ga.S		[Ga]=S		Gallium sulfide
17108859	GaCl	Gallium monochloride	InChI=1S/ClH.Ga/h1H;/q;+1/p-1	XOYLJNJLGBYDTH-UHFFFAOYSA-M	[Ga]Cl
17108859	GaCl+	Gallium monochloride cation	InChI=1S/ClH.Ga/h1H;/q;+2/p-1	UQTZHOXMCYYRHV-UHFFFAOYSA-M	[Ga+]Cl
13966784	GaF	Gallium monofluoride	InChI=1S/FH.Ga/h1H;/q;+1/p-1	CXPXVVXGLWMDKK-UHFFFAOYSA-M	[Ga]F
13966784	GaF+	Gallium monofluoride cation	InChI=1S/FH.Ga/h1H;/q;+2/p-1	DGOJITKNTKQYRA-UHFFFAOYSA-M	[Ga+]F
12596053	Ge2	Germanium diatomic	InChI=1S/Ge2/c1-2	VXGHASBVNMHGDI-UHFFFAOYSA-N	[Ge][Ge]
12334268	GeC	Germanium monocarbide	InChI=1S/CGe/c1-2	DZWOAPKTBKPJAH-UHFFFAOYSA-N	[Ge][C]
145998023	SiGe	Silicon Germanium	InChI=1S/GeSi/c1-2		[Si][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	VDNSGQQAZRMTCI-UHFFFAOYSA-N	[Ge]=S
20619163	GeO	Germanium monoxide	InChI=1S/GeO/c1-2	PVADDRMAFCOOPC-UHFFFAOYSA-N	[Ge][O]		germanium(II) oxide
20619163	GeO+	Germanium monoxide cation	InChI=1S/GeO/c1-2/q+1	KYXFLUPILCZFRT-UHFFFAOYSA-N	[Ge+]=O
14929465	GeF	Germanium monofluoride	InChI=1S/FGe/c1-2	HHFCFXJTAZTLAO-UHFFFAOYSA-N	[Ge]F
14929465	GeF+	Germanium monofluoride cation	InChI=1S/FGe/c1-2/q+1		[Ge+]F
9000388	GeCl	Germanium monochloride	InChI=1S/ClGe/c1-2	MFWRCAQESKCGKS-UHFFFAOYSA-N	[Ge]Cl
9000388	GeCl+	Germanium monochloride cation	InChI=1S/ClGe/c1-2/q+1		[Ge+]Cl
13537309	GeH3F	monofluorogermane	InChI=1S/FGeH3/c1-2/h2H3	BCQKCDCVNZQJKN-UHFFFAOYSA-N	[GeH3]F
13637655	GeH3Cl	monochlorogermane	InChI=1S/ClGeH3/c1-2/h2H3	OWKFZBJFYBIPMX-UHFFFAOYSA-N	[GeH3]Cl		Chlorogermane; Germanium chloride hydride; Germyl chloride; Germane, chloro-
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]
12255333	AsP	Arsenic monophosphide	InChI=1S/AsP/c1-2	CFLINJYOEUVYMI-UHFFFAOYSA-N	[As][P]
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
12044790	AsS	Arsenic monosulfide	InChI=1S/AsS/c1-2	LAJUJGVZCLKIKB-UHFFFAOYSA-N	[As]=S
17522780	AsCl	Arsenic monochloride	InChI=1S/AsCl/c1-2		[As]Cl
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]
64171419	LiSe	Lithium monoselenide	InChI=1S/Li.Se		[Li][Se]
12006052	AsSe	Arsenic monoselenide	InChI=1S/AsSe/c1-2	UEQXZDBVFNJKDD-UHFFFAOYSA-N	[As]=[Se]
12033599	NSe	Nitrogen monoselenide	InChI=1S/NSe/c1-2	PWNCVPLOQRESLN-UHFFFAOYSA-N	[N]=[Se]		Selenium nitride
12065100	GeSe	Germanium monoselenide	InChI=1S/GeSe/c1-2		[Ge]=[Se]		germanium selenide
12211006	SiSe	Silicon Monoselenide	InChI=1S/SeSi/c1-2		[Si][Se]		Silicon selenide; Silylene, selenoxo-
12211006	SiSe+	Silicon Monoselenide cation	InChI=1S/SeSi/c1-2/q+1		[Si]=[Se+]
12185170	Se2-	selenium diatomic 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 diatomic cation	InChI=1S/Se2/c1-2/q+1	VPTDTTKFVJBMIM-UHFFFAOYSA-N	[Se+]=[Se]
12509410	PSe	Phosphorus monoselenide	InChI=1S/PSe/c1-2	DFRFKDSWUNYYGW-UHFFFAOYSA-N	[P]=[Se]		Selenium phosphide
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+]
24765455	H2Se2	hydrogen diselenide	InChI=1S/H2Se2/c1-2/h1-2H		[SeH][SeH]		Hydrogen selenide; Dihydrogen diselenide
6596505	H2CSe	Selenoformaldehyde	InChI=1S/CH2Se/c1-2/h1H2		C=[Se]		Methaneselenal
204	CH3SeH	Methane selenol	InChI=1S/CH4Se/c1-2/h2H,1H3	APKHDKJWSHYLEU-UHFFFAOYSA-N	C[Se]
21259369	SeCl	Selenium monochloride	InChI=1S/ClSe/c1-2	CQLXIRWXLDRSTJ-UHFFFAOYSA-N	[Se]Cl		Selenium chloride
16846712	SeF	Selenium monofluoride	InChI=1S/FSe/c1-2	MWHREXSRHFCLNE-UHFFFAOYSA-N	[Se]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]
15656196	BrO+	Bromine monoxide cation	InChI=1S/BrO/c1-2/q+1		[Br+]=O
14791572	SiBr	Silicon monobromide	InChI=1S/BrSi/c1-2		[Si]Br		Bromosilylidyne; Silylidyne, bromo-
14791572	SiBr+	Silicon monobromide cation	InChI=1S/BrSi/c1-2/q+1		[Si][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
22359973	AlBr	Aluminum monobromide	InChI=1S/Al.BrH/h;1H/q+1;/p-1		[Al]Br
22655590	GaBr	Gallium monobromide	InChI=1S/BrH.Ga/h1H;/q;+1/p-1		[Ga]Br
19961296	BBr	Boron monobromide	InChI=1S/BBr/c1-2	YXCOLLAIMXVWPV-UHFFFAOYSA-N	[B]Br
59727161	PBr	Phosphorus monobromide	InChI=1S/BrP/c1-2		[P]Br		Bromophosphinidene
74140673	SBr	Sulfur monobromide radical	InChI=1S/BrS/c1-2		[S]Br
74140673	SBr+	Sulfur monobromide cation	InChI=1S/BrS/c1-2/q+1		S=[Br+]
7550358	LiBr-	lithium bromide anion	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 cation	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
7758023	KBr	Potassium Bromide	InChI=1S/BrH.K/h1H;/q;+1/p-1	IOLCXVTUBQKXJR-UHFFFAOYSA-M	[K]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		Dibromine; Broom; Brome; Bromo; Brom
7726956	Br2+	bromine diatomic cation	InChI=1S/Br2/c1-2/q+1	YZABTPRDHYVJNU-UHFFFAOYSA-N	[Br+]Br
12598708	SeBr	Selenium monobromide	InChI=1S/BrSe/c1-2		[Se]Br
10024438	CaBr	Calcium monobromide	InChI=1S/BrH.Ca/h1H;/q;+1/p-1	NJBLGWVFUHAPEF-UHFFFAOYSA-M	[Ca]Br
3889778	CBr	Carbon monobromide	InChI=1S/CBr/c1-2	AOJDZKCUAATBGE-UHFFFAOYSA-N	[C]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+]
17141285	CHBr	bromomethylene	InChI=1S/CHBr/c1-2/h1H	PRCFIJGWTCBHPP-UHFFFAOYSA-N	[CH]Br
13569454	HSiBr	monobromosilylene	InChI=1S/BrHSi/c1-2/h2H		[SiH]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
13465731	SiH3Br	bromosilane	InChI=1S/BrH3Si/c1-2/h2H3	VQPFDLRNOCQMSN-UHFFFAOYSA-N	[SiH3]Br		monobromosilane
12333572	SbN	Antimony nitride	InChI=1S/N.Sb		[Sb][N]
19952126	SbCl	Antimony monochloride	InChI=1S/ClH.Sb/h1H;/q;+1/p-1		[Sb]Cl		Antimony Chloride
25285727	SbF	Antimony monofluoride	InChI=1S/FH.Sb/h1H;/q;+1/p-1		[Sb]F		Antimony fluoride
13451177	TeO	Tellurium monoxide	InChI=1S/OTe/c1-2	QGMWCJPYHVWVRR-UHFFFAOYSA-N	[Te]=O
10028167	Te2	Tellurium diatomic	InChI=1S/Te2/c1-2	JPIIVHIVGGOMMV-UHFFFAOYSA-N	[Te]=[Te]		Ditellurium
10377512	LiI	Lithium Iodide	InChI=1S/HI.Li/h1H;/q;+1/p-1	HSZCZNFXUDYRKD-UHFFFAOYSA-M	[Li]I
7681825	NaI	Sodium Iodide	InChI=1S/HI.Na/h1H;/q;+1/p-1	FVAUCKIRQBBSSJ-UHFFFAOYSA-M	[Na]I
7681110	KI	Potassium Iodide	InChI=1S/HI.K/h1H;/q;+1/p-1	NLKNQRATVPKPDG-UHFFFAOYSA-M	[K]I
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+]
7790990	ICl	Iodine monochloride	InChI=1S/ClI/c1-2	QZRGKCOWNLSUDK-UHFFFAOYSA-N	ICl
7789335	IBr	Iodine monobromide	InChI=1S/BrI/c1-2	CBEQRNSPHCCXSH-UHFFFAOYSA-N	IBr
29977411	AlI	Aluminum monoiodide	InChI=1S/Al.HI/h;1H/q+1;/p-1		[Al]I
14696981	IO	Iodine monoxide	InChI=1S/IO/c1-2	AFSVSXMRDKPOEW-UHFFFAOYSA-N	I[O]		Iodine oxide
13873842	IF	Iodine monofluoride	InChI=1S/FI/c1-2	PDJAZCSYYQODQF-UHFFFAOYSA-N	IF
14332219	HOI	Hypoiodous acid	InChI=1S/HIO/c1-2/h2H	GEOVEUCEIQCBKH-UHFFFAOYSA-N	OI
13598420	SiH3I	Silyl Iodide	InChI=1S/H3ISi/c1-2/h2H3	IDIOJRGTRFRIJL-UHFFFAOYSA-N	[SiH3]I		Iodosilane
74884	CH3I	methyl iodide	InChI=1S/CH3I/c1-2/h1H3	INQOMBQAUSQDDS-UHFFFAOYSA-N	CI		Methane, iodo-; Iodomethane; Halon 10001; 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	InChI=1S/C3H3/c1-2-3-1/h1-3H	UKPXULFIISGBHG-UHFFFAOYSA-N	[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
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; Propene; Propylene; prop-1-ene
75194	C3H6	Cyclopropane	InChI=1S/C3H6/c1-2-3-1/h1-3H2	LVZWSLJZHVFIQJ-UHFFFAOYSA-N	C1CC1		Cyclopropane; Trimethylene; Trimethylene (cyclic)
2025550	CH3CHCH3	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
2025550	CH3CHCH3+	Isopropyl cation	InChI=1S/C3H7/c1-3-2/h3H,1-2H3/q+1	MONCCXHJSVPFQF-UHFFFAOYSA-N	C[CH+]C		prop-2-yl cation; Isopropylium; 1-Methylethylium; 2-Propyl cation; 2-Propylium
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
9000920	C3H7+	cyclopropane, protonated	InChI=1S/C3H7/c1-2-3-1/h1-2H2,3H3/q+1		C1C[CH3+]1		n-propyl cation
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
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]
2468817	CNN	Diazocarbene	InChI=1S/CN2/c1-3-2	QDZARNQKIZUXDK-UHFFFAOYSA-N	[C]=[N+]=[N-]
1884646	NCN	Cyanoimidogen	InChI=1S/CN2/c2-1-3	NFKMPKOGCRBAJF-UHFFFAOYSA-N	[N]=C=[N]		Cyanonitrene
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
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
7782798	HN3+	Hydrazoic acid cation	InChI=1S/HN3/c1-3-2/h1H/q+1		[NH][N+]#N		Hydrazoic acid radical cation
20813325	HCNN	diazomethyl radical	InChI=1S/CHN2/c1-3-2/h1H		[CH]=[N+]=[N-]		Diazomethyl
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
151519	HNCNH	diiminomethane	InChI=1S/CH2N2/c2-1-3/h2-3H	VPKDCDLSJZCGKE-UHFFFAOYSA-N	N=C=N
157222	CH2N2	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-]
43422908	NH2NN+	hydrazoic acid, protonated	InChI=1S/H2N3/c1-3-2/h1H2/q+1		N[N+]#N		Diazonium, amino-; Aminodiazonium
950477813	HNNNH+	1,2-Triazadienium	InChI=1S/H2N3/c1-3-2/h1-2H/q+1		N=[N+]=N		hydrozoic acid, protonated
53768404	NH2CNH+	cyanamide, cn protonated	InChI=1S/CH2N2/c2-1-3/h2H2/p+1		[NH+]#CN
52324046	HCCNH2	Ethynamine	InChI=1S/C2H3N/c1-2-3/h1H,3H2		C#CN
88333022	H2CNCH	methyleneaminomethylene	InChI=1S/C2H3N/c1-3-2/h1H,2H2		C=N[CH]
17619226	H2CCNH	Ethenimine	InChI=1S/C2H3N/c1-2-3/h3H,1H2	ZUKSLMGYYPZZJD-UHFFFAOYSA-N	C=C=N
9000922	NH3CN+	cyanamide, amine protonated	InChI=1S/CH2N2/c2-1-3/h2H2/p+1		[NH3+]C#N
9000800	NCNH3+	Cyanamide, protonated	InChI=1S/CH2N2/c2-1-3/h2H2/p+1	XZMCDFZZKTWFGF-UHFFFAOYSA-O	N#C[NH3+]
9000801	HNCNH2+	diiminomethane, protonated	InChI=1S/CH2N2/c2-1-3/h2-3H/p+1	VPKDCDLSJZCGKE-UHFFFAOYSA-O	N=C=[NH2+]
157164	CHNCH2	2H-Azirine	InChI=1S/C2H3N/c1-2-3-1/h1H,2H2	NTJMGOWFGQXUDY-UHFFFAOYSA-N	N1=CC1
157164	HCNCH2+	2H-Azirine cation	InChI=1S/C2H3N/c1-2-3-1/h1H,2H2/q+1		[N+]1=CC1
157175	CHNHCH	1H-Azirine	InChI=1S/C2H3N/c1-2-3-1/h1-3H	ZHKJHQBOAJQXQR-UHFFFAOYSA-N	N1C=C1
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; USAF ek-488
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+]
593759	CH3NC	methyl isocyanide	InChI=1S/C2H3N/c1-3-2/h1H3	ZRKSVHFXTRFQFL-UHFFFAOYSA-N	C[N+]#[C-]		Methane, isocyano-; isocyanomethane; Methyl isonitrile
10000	NHCHNH2	aminomethanimine	InChI=1S/CH4N2/c2-1-3/h1H,(H3,2,3)	PNKUSGQVOMIXLU-UHFFFAOYSA-N	NC=N
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
18447535	NH2BHNH2	diaminoborane	InChI=1S/BH5N2/c2-1-3/h1H,2-3H2		NBN		Borane, diamino-
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
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; TL 337
593679	CH2CHNH2	aminoethene	InChI=1S/C2H5N/c1-2-3/h2H,1,3H2	UYMKPFRHYYNDTL-UHFFFAOYSA-N	C=CN		Vinylamine; Aminoethylene; Ethenamine; Ethylenamine; Ethyleneamine
1761677	CH2NCH3	N-methylmethanimine	InChI=1S/C2H5N/c1-3-2/h1H2,2H3	NYVSDPNXBIEFPW-UHFFFAOYSA-N	C=NC		2-Azapropene; N-methylenemethanamine
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
9000909	C2H5NH+	Protonated Aziridine	InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2/p+1	NOWKCMXCCJGMRR-UHFFFAOYSA-O	[NH2+]1CC1
9000916	C2H6N+	aziridine, protonated	InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2/p+1		[NH2+]1CC1
62901706	NH2CH2NH3+	diaminoethane, protonated	InChI=1S/CH6N2/c2-1-3/h1-3H2/p+1		NC[NH3+]
124403	CH3NHCH3	Dimethylamine	InChI=1S/C2H7N/c1-3-2/h3H,1-2H3	ROSDSFDQCJNGOL-UHFFFAOYSA-N	CNC		Dimethylamine; DMA; Methanamine, N-methyl-; 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
75047	CH3CH2NH2	Ethylamine	InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3		CCN		1-Aminoethane; Aethylamine; Aminoethane; Ethanamine; Ethylamine; Etilamina; Etyloamina; Monoethylamine
848779204	CH3CH2NH3+	ethylamine, protonated	InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3/p+1	QUSNBJAOOMFDIB-UHFFFAOYSA-O	[NH3+]CC		ethylammonium cation
145384527	(CH3)2NH2+	dimethylammonium cation	InChI=1S/C2H7N/c1-3-2/h3H,1-2H3/p+1	ROSDSFDQCJNGOL-UHFFFAOYSA-O	C[NH2+]C		Dimethyl amine, protonated
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
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
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-]
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	[O-]B=O
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]
12071237	CCO	Dicarbon monoxide	InChI=1S/C2O/c1-2-3	VILAVOFMIJHSJA-UHFFFAOYSA-N	[C]=C=O
12136560	LiO2	Lithium dioxide	InChI=1S/Li.2O		[O][Li][O]		Lithium Superoxide
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]
10102440	NO2-	Nitrogen dioxide anion	InChI=1S/HNO2/c2-1-3/h(H,2,3)/p-1	IOVCWXUNBOPUCH-UHFFFAOYSA-M	[O-]N=O		nitrite
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; Stickstoffdioxid; Stikstofdioxyde
10102440	NO2+	Nitrogen dioxide cation	InChI=1S/NO2/c2-1-3/q+1	OMBRFUXPXNIUCZ-UHFFFAOYSA-N	O=[N+]=O		nitronium
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	[O-]N=[N]
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
10024972	N2O+	Nitrous oxide cation	InChI=1S/N2O/c1-2-3/q+1	BEZCXZPDDIVIRI-UHFFFAOYSA-N	[N]=[N+]=O
10028156	O3-	Ozone anion	InChI=1S/O3/c1-3-2/q-1	QOHPWKJMIUDENU-UHFFFAOYSA-N	[O]O[O-]		ozonide; Trioxidan-1-id-3-yl
10028156	O3-	Ozone anion	InChI=1S/O3/c1-3-2/q-1	QOHPWKJMIUDENU-UHFFFAOYSA-N	[O]O[O-]		ozonide; Trioxidan-1-id-3-yl
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
12500786	O3H+	protonated ozone	InChI=1S/HO3/c1-3-2/h1H/q+1	FQWSHTCXTQFHJZ-UHFFFAOYSA-N	O[O+]=O
12500786	O3H+	protonated ozone	InChI=1S/HO3/c1-3-2/h1H/q+1	FQWSHTCXTQFHJZ-UHFFFAOYSA-N	O[O+]=O
12311976	HCO2-	formate anion	InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)/p-1	BDAGIHXWWSANSR-UHFFFAOYSA-M	O=C[O-]
9000392	HCOO	formate neutral radical	InChI=1S/CHO2/c2-1-3/h1H	JRCLCXAVSVCEQC-UHFFFAOYSA-N	O=C[O]
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]
76412549	NNOH+	Nitrous Oxide, O-protonated	InChI=1S/N2O/c1-2-3/p+1	GQPLMRYTRLFLPF-UHFFFAOYSA-O	N#[N+]O
107190772	HNNO	nitrosoazane	InChI=1S/HN2O/c1-2-3/h1H		[NH]N=O
107190772	HNNO+	Nitrous oxide, N-protonated	InChI=1S/HN2O/c1-2-3/h1H/q+1	IMYMYABFOBYCQP-UHFFFAOYSA-N	N=[N+]=O
107190772	HNNO+	Nitrous oxide, N-protonated	InChI=1S/HN2O/c1-2-3/h1H/q+1	IMYMYABFOBYCQP-UHFFFAOYSA-N	N=[N+]=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
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
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	O=C=[OH+]		protonated carbon dioxide; hydroxy(oxo)methylium
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
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
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+]
157186	C2H2O	Oxirene	InChI=1S/C2H2O/c1-2-3-1/h1-2H	BJEYNNFDAPPGST-UHFFFAOYSA-N	O1C=C1
157266	CH2O2	Dioxirane	InChI=1S/CH2O2/c1-2-3-1/h1H2	ASQQEOXYFGEFKQ-UHFFFAOYSA-N	O1OC1
56077920	H2COO	Dioxymethyl radical	InChI=1S/CH2O2/c1-3-2/h1H2		C=[O+][O-]		Criegee intermediate; Carbonyl oxide; Formaldehyde oxide; methylene peroxy
56077920	H2COO+	dioxymethyl cation	InChI=1S/CH2O2/c1-3-2/h1H2/q+1		C=[O+][O]		methylene peroxy cation
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
13327327	Be(OH)2	Beryllium hydroxide	InChI=1S/Be.2H2O/h;2*1H2/q+2;;/p-2		O[Be]O
13327327	Be(OH)2	Beryllium hydroxide	InChI=1S/Be.2H2O/h;2*1H2/q+2;;/p-2		O[Be]O
13327327	Be(OH)2	Beryllium hydroxide	InChI=1S/Be.2H2O/h;2*1H2/q+2;;/p-2		O[Be]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	OC=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	OC=N OC=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	OC=N
9000344	CH2OOH	CH2OOH radical	InChI=1S/CH3O2/c1-3-2/h2H,1H2	CIWKZUVHMBXKEZ-UHFFFAOYSA-N	[CH2]C=O
41084893	CH2COH+	ketene, protonated	InChI=1S/C2H2O/c1-2-3/h1H2/p+1		C=C=[OH+]
79723210	CH3BO	Borane, methyloxo-	InChI=1S/CH3BO/c1-2-3/h1H3	UYVGUZKUXWFNRX-UHFFFAOYSA-N	CB=O		Methyl(oxo)borane
75172	CH2NOH	formaldoxime	InChI=1S/CH3NO/c1-2-3/h3H,1H2	SQDFHQJTAWCFIB-UHFFFAOYSA-N	C=NO		formaldehyde oxime
75127	CHONH2	formamide	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)	ZHNUHDYFZUAESO-UHFFFAOYSA-N	NC=O		Amid kyseliny mravenci; Formimidic acid; formamide; Methanamide; Carbamaldehyde
75127	CHONH2	formamide	InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2H2	ZHNUHDYFZUAESO-RZDQGJFANA-N	NC=O		Amid kyseliny mravenci; Formimidic acid; formamide; Methanamide; 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; Methanamide; Carbamaldehyde
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	CO[O-]
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
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
865407	CH3NO	nitrosomethane	InChI=1S/CH3NO/c1-2-3/h1H3	IMHRONYAKYWGCC-UHFFFAOYSA-N	CN=O
422506716	CH2BOH	hydroxy(methylene)borane	InChI=1S/CH3BO/c1-2-3/h3H,1H2	CZEUABRGABCIIL-UHFFFAOYSA-N	C=BO
557755	CH2CHOH	ethenol	InChI=1S/C2H4O/c1-2-3/h2-3H,1H2	IMROMDMJAWUWLK-UHFFFAOYSA-N	C=CO		Vinyl alcohol; Hydroxyethylene; ethenol
3031730	CH3OOH	Methyl peroxide	InChI=1S/CH4O2/c1-3-2/h2H,1H3	MEUKEBNAABNAEX-UHFFFAOYSA-N	OOC		Hydroperoxide, methyl; methyl Hydroperoxide; hydroperoxymethane
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; Octowy aldehyd
75070	CH3CHO+	acetaldehyde cation	InChI=1S/C2H4O/c1-2-3/h2H,1H3/q+1		C[CH+][O]
75218	C2H4O	Ethylene oxide	InChI=1S/C2H4O/c1-2-3-1/h1-2H2	IAYPIBMASNFSPL-UHFFFAOYSA-N	C1CO1		α,β-Oxidoethane; 1,2-Epoxyethane; Dihydrooxirene; Dimethylene oxide; E.O.; Epoxyethane; Ethene oxide; Oxacyclopropane; Oxirane; Oxirene, Dihydro-; alpha,beta-Oxidoethane
75218	C2H4O+	ethylene oxide cation	InChI=1S/C2H4O/c1-2-3-1/h1-2H2/q+1		[O+]1CC1
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		methylene glycol
74427284	H2COCH2+	Methyl, (methyleneoxoniumyl)-	InChI=1S/C2H4O/c1-3-2/h1-2H2/q+1		[CH2][O+]=C
50785803	NH2CHOH+	Formamide, O-protonated	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)/p+1		[OH+]=CN
9000924	NH3CHO+	Formamide, N-Protonated
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	N[CH+]O
9000915	C2H4OH+	ethylene oxide, protonated	InChI=1S/C2H4O/c1-2-3-1/h1-2H2/p+1		[OH+]1CC1
16520040	CH3OCH2	methoxymethyl radical	InChI=1S/C2H5O/c1-3-2/h1H2,2H3	AFGPRWUFPLEMTF-UHFFFAOYSA-N	CO[CH2]
3088275	NH2CH2OH	aminomethanol	InChI=1S/CH5NO/c2-1-3/h3H,1-2H2	XMYQHJDBLRZMLW-UHFFFAOYSA-N	NCO		Carbinolamine; hydroxymethylamine
2154509	CH3CH2O	Ethoxy radical	InChI=1S/C2H5O/c1-2-3/h2H2,1H3	VOLGAXAGEUPBDM-UHFFFAOYSA-N	CC[O]
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; α-Hydroxyethyl
2348461	CH3CHOH+	acetaldehyde, protonated	InChI=1S/C2H5O/c1-2-3/h2-3H,1H3/q+1	GVWBHEKHFYAXOH-UHFFFAOYSA-N	C[CH+]O
2348461	CH3CHOH+	acetaldehyde, protonated	InChI=1S/C2H4O/c1-2-3/h2H,1H3/p+1	IKHGUXGNUITLKF-UHFFFAOYSA-O	CC=[OH+]
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
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
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; Alcohol; Ethanol; Ethyl alcohol; EtOH; Grain alcohol; Methylcarbinol
64175	CH3CH2OH	Ethanol	InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3	LFQSCWFLJHTTHZ-UHFFFAOYSA-N	CCO		Absolute ethanol; Alcohol; Ethanol; Ethyl alcohol; EtOH; Grain alcohol; Methylcarbinol
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
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
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
15499237	FOO	Dioxygen monofluoride radical	InChI=1S/FO2/c1-3-2	GQRAHKRZRKCZPQ-UHFFFAOYSA-N	FO[O]		Oxygen fluoride
15499237	FOO+	Fluorine dioxide cation	InChI=1S/FO2/c1-3-2/q+1		O=[O+]F		Dioxygen monofluoride cation
13842552	BF2	Boron difluoride radical	InChI=1S/BF2/c2-1-3	OKZIUSOJQLYFSE-UHFFFAOYSA-N	F[B]F
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-]
23361560	FBO	Boron monofluoride monoxide	InChI=1S/BFO/c2-1-3		FB=O		Boron fluoride oxide; Fluorooxoborane
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
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); hypofluorous anhydride
866495150	CNF	iso cyanogen fluoride	InChI=1S/CFN/c1-3-2		[C]#[N]F		Fluorine isocyanide
10405273	NHF2	difluoramine	InChI=1S/F2HN/c1-3-2/h3H	ULFHSQLFQYTZLS-UHFFFAOYSA-N	FNF
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
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+]
2670135	CHF2	difluoromethyl radical	InChI=1S/CHF2/c2-1-3/h1H	JNCMHMUGTWEVOZ-UHFFFAOYSA-N	F[CH]F		Methyl radical, difluoro-
2670135	CHF2+	difluoromethyl cation	InChI=1S/CHF2/c2-1-3/h1H/q+1		F[CH+]F
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; 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
420031	CH2FOH	fluoromethanol	InChI=1S/CH3FO/c1-3-2/h1H3	XMSZANIMCDLNKA-UHFFFAOYSA-N	FCO
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]
143339	NaCN	Sodium Cyanide	InChI=1S/CN.Na/c1-2;	RTVFYQXEHKQMKO-UHFFFAOYSA-N	[C]#[N][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
12034127	NaO2	Sodium superoxide	InChI=1S/Na.O2/c;1-2/q+2;-2		[Na]1OO1
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
19401015	AlCN	Aluminum monocyanide	InChI=1S/CN.Al/c1-2;		[Al]C#N		Aluminum cyanide
61192709	AlNC	Aluminum isocyanide	InChI=1S/CN.Al/c1-2;		[Al][N]#[C]
12071271	SiC2	Silicon dicarbide	InChI=1S/C2Si/c1-2-3-1		[Si]1C#C1
7783268	Si3H8	trisilane	InChI=1S/H8Si3/c1-3-2/h3H2,1-2H3	VEDJZFSRVVQBIL-UHFFFAOYSA-N	[SiH3][SiH2][SiH3]		Silicopropane; Trisilicane
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
13824367	SiH2F2	difluorosilane	InChI=1S/F2H2Si/c1-3-2/h3H2	PUUOOWSPWTVMDS-UHFFFAOYSA-N	F[SiH2]F		Silane, difluoro-
753446	CH3SiFH2	fluoromethylsilane	InChI=1S/CH5FSi/c1-3-2/h3H2,1H3		C[SiH2]F
676595	CH3PHCH3	dimethylphosphine	InChI=1S/C2H7P/c1-3-2/h3H,1-2H3	YOTZYFSGUCFUKA-UHFFFAOYSA-N	CPC
114584268	PPO	Phosphorus oxide phosphide	InChI=1S/OP2/c1-3-2	BUYIAIMTTAEIOB-UHFFFAOYSA-N	[P-][P+]=O
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
13873524	PF2	Phosphorus difluoride	InChI=1S/F2P/c1-3-2	MSGYRGHIEBLFLX-UHFFFAOYSA-N	F[P]F
13873524	PF2+	Phosphorus difluoride cation	InChI=1S/F2P/c1-3-2/q+1		F[P+]F
13759109	SiS2	Silicon disulfide	InChI=1S/S2Si/c1-3-2	KHDSWONFYIAAPE-UHFFFAOYSA-N	[S][Si][S]		silicon disulphide
15941772	SCN-	thiocyanide anion	InChI=1S/CNS/c2-1-3/q-1	ZBKFYXZXZJPWNQ-UHFFFAOYSA-N	S=C=[N-]		thiocyanate
15941772	SCN	thiocyanato radical	InChI=1S/CNS/c2-1-3	NYAZXHASVIWIRJ-UHFFFAOYSA-N	[N]=C=S
56400023	NNS	Nitrogen sulfide	InChI=1S/N2S/c1-2-3	OBISXEJSEGNNKL-UHFFFAOYSA-N	[N-]=[N+]=S		Dinitrogen-N-sulfide; Nitrous sulfide
56971198	SNO	Nitrogen oxide sulfide	InChI=1S/NOS/c2-1-3		[S]N=O
20901217	SSO	Disulfur monoxide	InChI=1S/OS2/c1-3-2	TXKMVPPZCYKFAC-UHFFFAOYSA-N	S=S=O		Sulfur oxide; sulfur oxide 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]
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	InChI=1S/S3/c1-2-3-1		S1SS1
12597034	S3+	Sulfur trimer cation	InChI=1S/S3/c1-3-2/q+1	YKEMVFDZPHZNKQ-UHFFFAOYSA-N	[S][S+][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
7446095	SO2+	Sulfur dioxide cation	InChI=1S/O2S/c1-3-2/q+1	MBSJVKCGZVUJLB-UHFFFAOYSA-N	[O][S+][O]
1313822	Na2S	Sodium sulfide	InChI=1S/2Na.S		[Na]S[Na]		disodium sulfide
1313822	Na2S	Sodium sulfide	InChI=1S/2Na.S		[Na]S[Na]		disodium sulfide
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
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; Schwefelkohlenstoff; Solfuro di carbonio; Sulphocarbonic anhydride; Weeviltox; Wegla dwusiarczek
75150	CS2+	Carbon disulfide cation	InChI=1S/CS2/c2-1-3/q+1	PGXKVSYXGLLKDQ-UHFFFAOYSA-N	S=C=[S+]
166412619	NSO	sulfinyl amidogen	InChI=1S/NOS/c1-3-2		O=S=[N]
463569	HSCN	thiocyanic acid	InChI=1S/CHNS/c2-1-3/h3H	ZMZDMBWJUHKJPS-UHFFFAOYSA-N	SC#N		Hydrogen thiocyanate; Sulfocyanic acid
3129906	HNCS	Isothiocyanic acid	InChI=1S/CHNS/c2-1-3/h2H	GRHBQAYDJPGGLF-UHFFFAOYSA-N	S=C=N		Hydrogen isothiocyanate
12306079	SO2H+	protonated sulfur dioxide	InChI=1S/HO2S/c1-3-2/h(H,1,2)	RAHZWNYVWXNFOC-UHFFFAOYSA-O	[O][S+]=O
87552861	CS2H+	Carbon disulfide, protonated	InChI=1S/CS2/c2-1-3/p+1		S=C=[SH+]
18282774	CH2CS	Thioketene	InChI=1S/C2H2S/c1-2-3/h1H2	CWMKZYCJCZVSHO-UHFFFAOYSA-N	C=C=S		Ethenethione; Ketene, thio-
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
60100109	NHCHSH	Methanimidothioic acid	InChI=1S/CH3NS/c2-1-3/h1H,(H2,2,3)
115082	CHSNH2	thioformamide	InChI=1S/CH3NS/c2-1-3/h1H,(H2,2,3)	CYEBJEDOHLIWNP-UHFFFAOYSA-N	S=CN		Methanethioamide
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
6725640	HSCH2SH	Methanedithiol	InChI=1S/CH4S2/c2-1-3/h2-3H,1H2	INBDPOJZYZJUDA-UHFFFAOYSA-N	SCS		dithiomethane; Dimercaptomethane
6251269	CH3SSH	Hydrogen methyl disulfide	InChI=1S/CH4S2/c1-3-2/h2H,1H3	KFLNNVFDKSNGBW-UHFFFAOYSA-N	CSS		Methanesulfenothioic acid; Methyl hydrodisulfide; Methanesulfenic acid, thio-
917599	CH2CHSH	Ethenethiol	InChI=1S/C2H4S/c1-2-3/h2-3H,1H2	QDXBVEACAWKSFL-UHFFFAOYSA-N	C=CS		Ethylenethiol; Mercaptoethylene; Vinyl mercaptan; Vinylthiol
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; dimethylsulfane
75183	CH3SCH3+	dimethyl sulfide cation	InChI=1S/C2H6S/c1-3-2/h1-2H3/q+1		C[S+]C
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
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
18820638	FSN	Thiazyl fluoride	InChI=1S/FNS/c1-3-2	IMFUYZDKLVTPSW-UHFFFAOYSA-N	N#SF
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
13537387	FNS	Thionitrosyl fluoride	InChI=1S/FNS/c1-2-3	VOGIKJZKYJITFG-UHFFFAOYSA-N	S=NF
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; 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	[O-][Cl]=O
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]
7787475	BeCl2	Beryllium chloride	InChI=1S/Be.2ClH/h;2*1H/q+2;;/p-2	LWBPNIJBHRISSS-UHFFFAOYSA-L	Cl[Be]Cl
7786303	MgCl2	Magnesium dichloride	InChI=1S/2ClH.Mg/h2*1H;/q;;+2/p-2	TWRXJAOTZQYOKJ-UHFFFAOYSA-L	Cl[Mg]Cl		Magnesium chloride
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
13569329	SiCl2	Dichlorosilylene	InChI=1S/Cl2Si/c1-3-2	BUMGIEFFCMBQDG-UHFFFAOYSA-N	Cl[Si]Cl		Dichlorosilylene; silicon dichloride
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
22363684	FClO	chlorosyl fluoride	InChI=1S/ClFO/c2-1-3	AXCBHWGTRNNXKG-UHFFFAOYSA-N	FCl=O
21295501	OPCl	Phosphorus oxychloride	InChI=1S/ClOP/c1-3-2		O=PCl		Phosphorus chloride oxide
64422260	SFCl	Sulfur chloride fluoride	InChI=1S/ClFS/c1-3-2		FSCl
53169269	ClSO	Sulfur chloride oxide	InChI=1S/ClOS/c1-3-2	JBZRLVKMCLOFLG-UHFFFAOYSA-N	Cl[S]=O		Chlorothionyl
39594917	ClS2	Sulfur chloride	InChI=1S/ClS2/c1-3-2	ASGYIKBYZKQKJC-UHFFFAOYSA-N	ClS[S]		Sulfur chloride
34240863	ClOF	Chlorine hypofluorite	InChI=1S/ClFO/c1-3-2	OBSJTVYTJSDZEO-UHFFFAOYSA-N	ClOF
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; cyanic chloride
1691889	CFCl	chlorofluoromethylene	InChI=1S/CClF/c2-1-3	KYKAJFCTULSVSH-UHFFFAOYSA-N	F[C]Cl		Chlorofluorocarbene; fluorochloromethylene
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
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)
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
3400097	NHCl2	dichloroamine	1S/Cl2HN/c1-3-2/h3H	JSYGRUBHOCKMGQ-UHFFFAOYSA-N	ClNCl
3474122	CHCl2	dichloromethyl radical	InChI=1S/CHCl2/c2-1-3/h1H	ZJULYDCRWUEPTK-UHFFFAOYSA-N	Cl[CH]Cl		Methyl, dichloro-; Dichloromethyl
3474122	CHCl2	dichloromethyl radical	InChI=1S/CHCl2/c2-1-3/h1H	ZJULYDCRWUEPTK-UHFFFAOYSA-N	Cl[CH]Cl		Methyl, dichloro-; Dichloromethyl
3474122	CHCl2+	dichloromethyl cation	InChI=1S/CHCl2/c2-1-3/h1H/q+1		Cl[CH+]Cl
2565302	COHCl	Formyl chloride	InChI=1S/CHClO/c2-1-3/h1H	GFAUNYMRSKVDJL-UHFFFAOYSA-N	O=CCl
593635	HCCCl	Chloroacetylene	InChI=1S/C2HCl/c1-2-3/h1H	DIWKDXFZXXCDLF-UHFFFAOYSA-N	C#CCl		Ethyne, chloro-; Acetylene, chloro-; Chloroethyne; Ethynyl chloride; Monochloroacetylene
33272718	CHFCl	Chlorofluoromethyl radical	InChI=1S/CHClF/c2-1-3/h1H	FICFQLDYKDCJHQ-UHFFFAOYSA-N	F[CH]Cl
33272718	CHFCl+	Chlorofluoromethyl cation	InChI=1S/CHClF/c2-1-3/h1H/q+1		F[CH+]Cl
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
10325390	BHCl2	Borane, dichloro-	InChI=1S/BCl2H/c2-1-3/h1H	LHCGBIFHSCCRRG-UHFFFAOYSA-N	ClBCl		Borane, dichloro-; Dichloroborane
593704	CH2FCl	fluorochloromethane	InChI=1S/CH2ClF/c2-1-3/h1H2	XWCDCDSDNJVCLO-UHFFFAOYSA-N	ClCF		Methane, chlorofluoro-; Chlorofluoromethane; Freon 31; Monochloromonofluoromethane; R 31
4109960	SiH2Cl2	dichlorosilane	InChI=1S/Cl2H2Si/c1-3-2/h3H2	MROCJMGDEKINLD-UHFFFAOYSA-N	Cl[SiH2]Cl
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; R 30; Solaesthin; Solmethine
75014	C2H3Cl	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; Vinyl chloride monomer; Vinylchlorid; Winylu chlorek; VC; Vinyl C monomer; Vinyl chloride; Vinyl chloride, inhibited; Trovidur; Vinyle(chlorure de); VCM; Vinile
593782	CH3OCl	methyl hypochlorite	InChI=1S/CH3ClO/c1-3-2/h1H3	UCFFGYASXIPWPD-UHFFFAOYSA-N	COCl
16519996	CH2CH2Cl	2-chloroethyl radical	InChI=1S/C2H4Cl/c1-2-3/h1-2H2	WOWSRBBIBJLBJW-UHFFFAOYSA-N	[CH2]CCl		β-Chloroethyl; β-Chloroethyl radical
16520131	CHClCH3	1-chloroethyl radical	InChI=1S/C2H4Cl/c1-2-3/h2H,1H3	JSICDMRDIHNAKT-UHFFFAOYSA-N	C[CH]Cl		Ethyl, 1-​chloro-; α-Chloroethyl
75003	CH3CH2Cl	Ethyl chloride	InChI=1S/C2H5Cl/c1-2-3/h2H2,1H3	HRYZWHHZPQKTII-UHFFFAOYSA-N	CCCl		Chloroethane; Ethane, chloro-; Ethyl Chloride; Monochloroethane
151508	KCN	Potassium cyanide	InChI=1S/CN.K/c1-2;	YUZRZFQHUCKACF-UHFFFAOYSA-N	N#C[K]
151508	KCN	Potassium cyanide	InChI=1S/CN.K/c1-2;	YUZRZFQHUCKACF-UHFFFAOYSA-N	[C]#[N][K]
151508	KCN	Potassium cyanide	InChI=1S/CN.K/c1-2;	YUZRZFQHUCKACF-UHFFFAOYSA-N	[C]1[N-][K+]1
10043524	CaCl2	Calcium Chloride	InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2	UXVMQQNJUSDDNG-UHFFFAOYSA-L	Cl[Ca]Cl
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
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
73963981	ZnCN	Zinc monocyanide	InChI=1S/CN.Zn/c1-2;		[Zn]C#N		Zinc cyanide
748101419	ZnNC	Zinc isocyanide	InChI=1S/CN.Zn/c1-2;		[Zn][N]#[C]
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
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
12025342	GeS2	Germanium disulfide	InChI=1S/GeS2/c2-1-3	YIZVROFXIVWAAZ-UHFFFAOYSA-N	S=[Ge]=S		germanium disulphide
1310538	GeO2	Germanium dioxide	InChI=1S/GeO2/c2-1-3	YBMRDBCBODYGJE-UHFFFAOYSA-N	[O][Ge][O]
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]
506809	CSe2	Carbon diselenide	InChI=1S/CSe2/c2-1-3	JNZSJDBNBJWXMZ-UHFFFAOYSA-N	[Se]=C=[Se]		Carbon selenide
5951199	SCSe	Carbon sulfide selenide	InChI=1S/CSSe/c2-1-3	UGVGOQWEDNFDPF-UHFFFAOYSA-N	S=C=[Se]		Carbo selenide; Thiocarbonyl selenide
7446084	SeO2	Selenium dioxide	InChI=1S/O2Se/c1-3-2	JPJALAQPGMAKDF-UHFFFAOYSA-N	O=[Se]=O		Selenium(IV) oxide; Selenium oxide; selenium dioxide
7446084	SeO2+	Selenium dioxide cation	InChI=1S/O2Se/c1-3-2/q+1	IZTZZSLQCBITTL-UHFFFAOYSA-N	O=[Se+]=O		Selenium oxide cation
593793	CH3SeCH3	dimethylselenide	InChI=1S/C2H6Se/c1-3-2/h1-2H3	RVIXKDRPFPUUOO-UHFFFAOYSA-N	C[Se]C		Selenium dimethyl; Dimethylselenium; Selenide, dimethyl-; Methyl selenide; Methyl selenium
14457706	SeCl2	Selenium Dichloride	InChI=1S/Cl2Se/c1-3-2	SWAKCLHCWHYEOW-UHFFFAOYSA-N	Cl[Se]Cl		Dichloroselenium
70421431	SeF2	Selenium difluoride	InChI=1S/F2Se/c1-3-2	YFFGQPRBGMOOJR-UHFFFAOYSA-N	FSeF
67177473	BrOO	Bromine dioxide	InChI=1S/BrO2/c1-3-2		BrO[O]
21308805	BrOBr	Bromine oxide	InChI=1S/Br2O/c1-3-2	HJCMMOODWZOXML-UHFFFAOYSA-N	BrOBr
22987457	SeBr2	Selenium dibromide	InChI=1S/Br2Se/c1-3-2	MNBLRJWKVLRTKV-UHFFFAOYSA-N	Br[Se]Br
21255834	OBrO	Bromine dioxide radical	InChI=1S/BrO2/c2-1-3	SISAYUDTHCIGLM-UHFFFAOYSA-N	[O]Br[O]
14312200	SBr2	Sulfur dibromide	InChI=1S/Br2S/c1-3-2	XXWVVIRTHDRMEY-UHFFFAOYSA-N	BrSBr
14522806	Br3-	tribromide anion	InChI=1S/Br3/c1-3-2/q-1		[Br-][Br+][Br-]
13444876	BrNO	Nitrosyl bromide	InChI=1S/BrNO/c1-2-3	BMNDJWSIKZECMH-UHFFFAOYSA-N	BrN=O
7789415	CaBr2	Calcium dibromide	InChI=1S/2BrH.Ca/h2*1H;/q;;+2/p-2		Br[Ca]Br		Calcium Bromide
7787464	BeBr2	Beryllium bromide	InChI=1S/Be.2BrH/h;2*1H/q+2;;/p-2	PBKYCFJFZMEFRS-UHFFFAOYSA-L	Br[Be]Br		Beryllium dibromide
9000328	BrOCl	Bromine hypochlorite	InChI=1S/BrClO/c1-3-2	QZMLUZQWJCKBQO-UHFFFAOYSA-N	BrOCl
4371771	CBr2	dibromomethylene	InChI=1S/CBr2/c2-1-3	WNLFIUJNNYMFIZ-UHFFFAOYSA-N	Br[C]Br		Carbon dibromide; Dibromocarbene; Methylene, dibromo-
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
593613	HCCBr	bromoacetylene	InChI=1S/C2HBr/c1-2-3/h1H	RUEKPBLTWGFBOD-UHFFFAOYSA-N	C#CBr		Acetylene, bromo-
7726116	COHBr	Formyl bromide	InChI=1S/CHBrO/c2-1-3/h1H	AIFARXRIYKCEEV-UHFFFAOYSA-N	O=CBr
14362131	CHBr2	dibromomethyl radical	InChI=1S/CHBr2/c2-1-3/h1H	HFPGRVHMFSJMOL-UHFFFAOYSA-N	Br[CH]Br		methyl, dibromo-
373524	CH2BrF	Methane, bromofluoro-	InChI=1S/CH2BrF/c2-1-3/h1H2	LHMHCLYDBQOYTO-UHFFFAOYSA-N	FCBr		Bromofluoromethane; Fluorobromomethane
74975	CH2BrCl	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
75161	CH3MgBr	Methyl Magnesium Bromide	InChI=1S/CH3.BrH.Mg/h1H3;1H;/q;;+1/p-1		C[Mg]Br		Magnesium, bromomethyl-; Bromomethylmagnesium; Methylmagnesium bromide
593602	C2H3Br	vinyl bromide	InChI=1S/C2H3Br/c1-2-3/h2H,1H2	INLLPKCGLOXCIV-UHFFFAOYSA-N	C=CBr		Ethene, bromo-; Vinylbromid; Bromoethene; Ethylene, bromo-; Bromoethylene; Bromure de vinyle
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; Ethane, bromo-; Bromic ether; 1-Bromoethane
13773814	KrF2	Krypton difluoride	InChI=1S/F2Kr/c1-3-2	QGOSZQZQVQAYFS-UHFFFAOYSA-N	F[Kr]F
10340064	SCTe	Carbon sulfide Telluride	InChI=1S/CSTe/c2-1-3		S=C=[Te]		Thiocarbonyl telluride
7446073	TeO2	Tellurium Dioxide	InChI=1S/O2Te/c1-3-2	LAJZODKXOMJMPK-UHFFFAOYSA-N	O=[Te]=O
506785	ICN	Cyanogen iodide	InChI=1S/CIN/c2-1-3	WPBXOELOQKLBDF-UHFFFAOYSA-N	IC#N		Iodine cyanide; Cyanogen monoiodide; Iodine monocyanide; Carbononitridic iodide
14900040	I3-	triiodide	InChI=1S/I3/c1-3-2/q-1		I[I-]I		iodide; Iodine triatomic anion
58585947	INO	Nitrosyl iodide	InChI=1S/INO/c1-2-3	VBAXOVGEFYCYMW-UHFFFAOYSA-N	O=NI
373535	CH2FI	fluoroiodomethane	InChI=1S/CH2FI/c2-1-3/h1H2	XGVXNTVBGYLJIR-UHFFFAOYSA-N	FCI
75116	CH2I2	Diiodomethane	InChI=1S/CH2I2/c2-1-3/h1H2	NZZFYRREKKOMAT-UHFFFAOYSA-N	ICI		methylene iodide; Methylene diiodide
593715	CH2ClI	chloroiodomethane	InChI=1S/CH2ClI/c2-1-3/h1H2	PJGJQVRXEUVAFT-UHFFFAOYSA-N	ClCI
557686	CH2BrI	bromoiodomethane	InChI=1S/CH2BrI/c2-1-3/h1H2	TUDWMIUPYRKEFN-UHFFFAOYSA-N	BrCI		Methane, bromoiodo-
593668	C2H3I	Vinyl iodide	InChI=1S/C2H3I/c1-2-3/h2H,1H2	GHXZPUGJZVBLGC-UHFFFAOYSA-N	C=CI		Ethene, iodo-; Iodoethene
75036	C2H5I	Ethyl iodide	InChI=1S/C2H5I/c1-2-3/h2H2,1H3	HVTICUPFWKNHNG-UHFFFAOYSA-N	CCI		Ethane, iodo-; iodoethane
13709369	XeF2	Xenon difluoride	InChI=1S/F2Xe/c1-3-2		F[Xe]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	[BH4]1[BH3]2[BH4][BH3]12		Boron hydride; Decahydrotetraborane; Tetraborane; arachno-tetraborane(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
157391	C4H4	Tetrahedrane	InChI=1S/C4H4/c1-2-3(1)4(1)2/h1-4H/t1-,2+,3-,4+		C12C3C1C23		Tricyclo[1.1.0.02,​4]​butane
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
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
2873509	H2CCCCH2	Butatriene	InChI=1S/C4H4/c1-3-4-2/h1-2H2	WHVXVDDUYCELKP-UHFFFAOYSA-N	C=C=C=C		cumulene; 1,2,3-Butatriene
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
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
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; butyne
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; Pyrrolylene; trans-Butadiene; Vinylethylene; alpha,gamma-Butadiene; 1,3butadiene; trans-1,3-butadiene
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; Pyrrolylene; trans-Butadiene; Vinylethylene; alpha,gamma-Butadiene; 1,3butadiene; trans-1,3-butadiene
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; 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
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-; gamma-Butylene; 2-methylprop-1-ene
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
593908	B(CH3)3	trimethylborane	InChI=1S/C3H9B/c1-4(2)3/h1-3H3	WXRGABKACDFXMG-UHFFFAOYSA-N	CB(C)C		trimethylboron
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
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
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; 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
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
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]
20815456	HNCCNH	Ethenediimine	InChI=1S/C2H2N2/c3-1-2-4/h3-4H	RUTRGUOJQDNDCQ-UHFFFAOYSA-N	N=C=C=N		Diiminoethylene; Vinylidenediimine
43730263	H2CNCN	cyanamide, methylene	InChI=1S/C2H2N2/c1-4-2-3/h1H2		C=NC#N		N-cyanomethanimine
624908	CH3N3	methyl azide	InChI=1S/CH3N3/c1-3-4-2/h1H3	PBTHJVDBCFJQGG-UHFFFAOYSA-N	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; TL 314; VCN; Ventox; Vinylkyanid; Vinyl cyanide
107131	C3H3N+	acrylonitrile cation	InChI=1S/C3H3N/c1-2-3-4/h2H,1H2/q+1	ZEKYDXZLIPYKBD-UHFFFAOYNA-N	[CH2][CH+]C#N
540614	NH2CH2CN	Aminoacetonitrile	InChI=1S/C2H4N2/c3-1-2-4/h1,3H2	DFNYGALUNNFWKJ-UHFFFAOYSA-N	NCC#N		Acetonitrile, amino-; AAN; 2-Aminoacetonitrile; Cyanomethylamine; Glycinenitrile; Glycinonitrile; α-Aminoacetonitrile
4403547	NH2CCNH2	Diaminoacetylene	InChI=1S/C2H4N2/c3-1-2-4/h3-4H2	PGAFCJWTBHYLDN-UHFFFAOYSA-N	NC#CN		1,​2-​Ethynediamine
4403547	NH2CCNH2	Diaminoacetylene	InChI=1S/C2H4N2/c3-1-2-4/h3-4H2		NC#CN		1,​2-​Ethynediamine
43732838	CH3NHN2+	methyl azide, protonated	InChI=1S/CH4N3/c1-3-4-2/h3H,1H3/q+1	ZIWHHHOGLBNHLH-UHFFFAOYSA-N	CN[N+]#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
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
4013438	H2NCHCHNH2	diaminoethylene	InChI=1S/C2H6N2/c3-1-2-4/h1-2H,3-4H2/b2-1+		N/C=C/N		1,​2-​Ethenediamine; Vinylenediamine; 1,2-Diaminoethylene
4013438	H2NCHCHNH2	diaminoethylene	InChI=1S/C2H6N2/c3-1-2-4/h1-2H,3-4H2		N/C=C/N		1,​2-​Ethenediamine; Vinylenediamine; 1,2-Diaminoethylene
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
4496962	CH7N3	triaminomethane	InChI=1S/CH7N3/c2-1(3)4/h1H,2-4H2		NC(N)N		Methanetriamine
765300	C3H7N	Cyclopropylamine	InChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2	HTJDQJBWANPRPF-UHFFFAOYSA-N	NC1CC1		Aminocyclopropane; Cyclopropanamine; Cyclopropylamine
503297	C3H7N	Azetidine	InChI=1S/C3H7N/c1-2-4-3-1/h4H,1-3H2	HONIICLYMWZJFZ-UHFFFAOYSA-N	N1CCC1		Azacyclobutane; Trimethylenimine; Azete, tetrahydro-; 1,3-Propylenimine
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; beta-Aminoethylamine; en
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
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; propan-1-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
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; propan-2-amine
9000910	C3H7NH3+	n-propylamine, protonated	InChI=1S/C3H9N/c1-2-3-4/h2-4H2,1H3/p+1	WGYKZJWCGVVSQN-UHFFFAOYSA-O	CCCC[NH3+]
145384538	(CH3)3NH+	protonated trimethyl amine	InChI=1S/C3H9N/c1-4(2)3/h1-3H3/p+1		C[NH+](C)C		Nitrogen, hydrotrimethyl- cation
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]
12031800	Li2O2	dilithium dioxide	InChI=1S/2Li.2O		[Li]1O[Li]O1
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
11127176	C3O	Tricarbon monoxide	InChI=1S/C3O/c1-2-3-4		[C]#C[C]=O		1,​2-​Propadien-​1-​ylidene, 3-​oxo-; 3-Oxo-1,2-propadien-1-ylidene; 3-Oxo-1,2-propadienylidene
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
13766284	B2O2	Diboron dioxide	InChI=1S/B2O2/c3-1-2-4	MTKRXXSLFWZJTB-UHFFFAOYSA-N	O=BB=O		Boron oxide; Diboron dioxide; diboron(III) dioxide
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
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		hydrogen carbonate
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		hydrogen carbonate
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	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
2961800	C2H2CO	cyclopropenone	InChI=1S/C3H2O/c4-3-1-2-3/h1-2H		O=C1C=C1		2-​Cyclopropen-​1-​one
624679	HCCCHO	2-propynal	InChI=1S/C3H2O/c1-2-3-4/h1,3H	IJNJLGFTSIAHEA-UHFFFAOYSA-N	C#CC=O		Propyn-3-al; Propiolaldehye; Propynal; 2-Propyn-1-one; Formylacetylene
7782947	NH2NO2	nitramide	InChI=1S/H2N2O2/c1-2(3)4/h1H2	SFDJOSRHYKHMOK-UHFFFAOYSA-N	N[N+]([O-])=O
61244937	C3H2O	Propadienal	InChI=1S/C3H2O/c1-2-3-4/h1H2	TURAMGVWNUTQKH-UHFFFAOYSA-N	C=C=C=O		1,​2-​Propadien-​1-​one; Ketene, methylene-; Methyleneketene; Propadienone
61244937	C3H2O	Propadienal	InChI=1S/C3H2O/c1-2-3-4/h1H2	TURAMGVWNUTQKH-UHFFFAOYSA-N	C=C=C=O		1,​2-​Propadien-​1-​one; Ketene, methylene-; Methyleneketene; Propadienone
54680523	C2H3NO	Nitrosoethylene	InChI=1S/C2H3NO/c1-2-3-4/h2H,1H2		C=CN=O		Nitrosoethene
9000360	H3CO3+	carbonic acid, protonated	InChI=1S/CH3O3/c2-1(3)4/h2-4H/q+1	RZAVWYXMFRWFJR-UHFFFAOYSA-N	O[C+](O)O
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
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
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
624839	CH3NCO	methylisocyante	1S/C2H3NO/c1-3-2-4/h1H3	HAMGRBXTJNITHG-UHFFFAOYSA-N	CN=C=O		Isocyanatomethane; Methane, isocyanato-
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
107164	HOCH2CN	cyanomethanol	1S/C2H3NO/c3-1-2-4/h4H,2H2	LTYRAPJYLUPLCI-UHFFFAOYSA-N	OCC#N		Acetonitrile, hydroxy-; Hydroxyacetonitrile; Glycolonitrile; Hydroxymethylnitrile
107164	HOCH2CN	cyanomethanol	1S/C2H3NO/c3-1-2-4/h4H,2H2	LTYRAPJYLUPLCI-UHFFFAOYSA-N	OCC#N		Acetonitrile, hydroxy-; Hydroxyacetonitrile; Glycolonitrile; Hydroxymethylnitrile
75525	CH3NO2	Methane, nitro-	InChI=1S/CH3NO2/c1-2(3)4/h1H3	LYGJENNIWJXYER-UHFFFAOYSA-N	C[N](=O)=O		Methane, nitro-; Nitrocarbol; Nitrometan; Nitromethane
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
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; Essigsaeure; Ethanoic acid; Ethylic acid; Glacial acetic acid; Kyselina octova; Methanecarboxylic acid; Octowy kwas; Vinegar acid
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; Isourea; Keratinamin; Mocovina; 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; Isourea; Keratinamin; Mocovina; 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; Isourea; Keratinamin; Mocovina; 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; Isourea; Keratinamin; Mocovina; 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	NC([NH2+])=O
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
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
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
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
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
6004440	C3H4O	Methylketene	InChI=1S/C3H4O/c1-2-3-4/h2H,1H3	UYLUJGRCKKSWHS-UHFFFAOYSA-N	O=C=CC
5009278	C3H4O	Cyclopropanone	InChI=1S/C3H4O/c4-3-1-2-3/h1-2H2	VBBRYJMZLIYUJQ-UHFFFAOYSA-N	O=C1CC1		Cyclopropanone
9000833	NH3COOH+	protonated Carbamic acid	InChI=1S/CH3NO2/c2-1(3)4/h2H2,(H,3,4)/p+1	KXDHJXZQYSOELW-UHFFFAOYSA-O	[NH3+]C(O)=O
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
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
15932895	HOCH2OOH	hydroxy methyl peroxide	InChI=1S/CH4O3/c2-1-4-3/h2-3H,1H2	NEZWFWIACBUQMN-UHFFFAOYSA-N	OCOO
271587032	NH2COOH2+	Carbamic acid, O-protonated	InChI=1S/CH3NO2/c2-1(3)4/h(H3,2,3,4)/p+1	OYJUEQXGUSSXFT-UHFFFAOYSA-O	OC(O)=[NH2+]
952102862	H2NCOHNH2+	urea, protonated	InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)/p+1	XSQUKJJJFZCRTK-UHFFFAOYSA-O	O[C+](N)N
99766582	CH2C(OH)NH2	1-amino vinyl alchohol	InChI=1S/C2H5NO/c1-2(3)4/h4H,1,3H2		C=C(O)N		1-aminoethen-1-ol; ethenol, 1-amino
27595751	CH3C(OH)=NH	Ethaninidic acid	InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)		CC(O)=N
27595751	CH3C(OH)=NH	Ethaninidic acid	InChI=1/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)/f/h3-4H/b3-2+
9000810	CH5N2O+	urea, N-protonated	InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)/p+1	XSQUKJJJFZCRTK-UHFFFAOYSA-O	O=C(N)[NH3+]
3122074	CH3COCH2	Acetonyl radical	InChI=1S/C3H5O/c1-3(2)4/h1H2,2H3	HNUKTDKISXPDPA-UHFFFAOYSA-N	O=C(C)[CH2]		2-Oxopropyl radical; Acetonyl; Acetylmethyl radical; 1-Methylvinoxy; Propyl, 2-​oxo-
3170614	C2H5OO	ethylperoxy radical	InChI=1S/C2H5O2/c1-2-4-3/h2H2,1H3	CGVQNDZUWCSFFT-UHFFFAOYSA-N	CCO[O]
123397	HCONHCH3	N-methylformamide	InChI=1S/C2H5NO/c1-3-2-4/h2H,1H3,(H,3,4)	ATHHXGZTWNVVOU-UHFFFAOYSA-N	O=CNC		Methylformamide; Monomethylformamide; Formamide, N-methyl-; N-Monomethylformamide; HCONHCH3
123397	HCONHCH3	N-methylformamide	InChI=1S/C2H5NO/c1-3-2-4/h2H,1H3,(H,3,4)	ATHHXGZTWNVVOU-UHFFFAOYSA-N	O=CNC		Methylformamide; Monomethylformamide; Formamide, N-methyl-; N-Monomethylformamide; HCONHCH3
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; 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; 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
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
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	C[C](C)[O-]
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; 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; beta-Ketopropane; propan-2-one
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; Shell unkrautted A; Shell Unkrauttod A; Vinylcarbinol; Weed drench; prop-2-en-1-ol
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; Oxirane, methyl-; Oxyde de propylene; Propane, 1,2-epoxy-; Propane, epoxy-; Propene oxide; Propylene epoxide; Propylene oxide; 2-methyloxirane
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; n-Propanal; n-Propionaldehyde; n-Propylal; Propaldehyde; Propanal; Propanalaldehyde; Propanaldehyde; Propional; Propionaldehyde; Propionic aldehyde; Propylaldehyde; Propylic aldehyde
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
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
29456040	C3H6O	Acetone enol	InChI=1S/C3H6O/c1-3(2)4/h4H,1H2,2H3	NARVIWMVBMUEOG-UHFFFAOYSA-N	CC(O)=C		propen-2-ol; 1-propen-2-ol; 2-Hydroxypropene; Isopropenyl alcohol
16545689	C3H5OH	Cyclopropanol	InChI=1S/C3H6O/c4-3-1-2-3/h3-4H,1-2H2	YOXHCYXIAVIFCZ-UHFFFAOYSA-N	OC1CC1
43022033	CH3COHCH3+	acetone, protonated	InChI=1S/C3H6O/c1-3(2)4/h1-2H3/p+1		[OH+]=C(C)C		1-hydroxy-1-methylethylium
141435	HOCH2CH2NH2	monoethanolamine	InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2	HZAXFHJVJLSVMW-UHFFFAOYSA-N	NCCO		MEA; Ethanol, 2-amino-; β-Aminoethanol; β-Aminoethyl alcohol; β-Hydroxyethylamine; Aminoethanol; Colamine; Ethanolamine; 2-Amino-1-Ethanol; β-Ethanolamine; 2-Aminoethan-1-ol
141435	HOCH2CH2NH2	monoethanolamine	InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2	HZAXFHJVJLSVMW-UHFFFAOYSA-N	NCCO		MEA; Ethanol, 2-amino-; β-Aminoethanol; β-Aminoethyl alcohol; β-Hydroxyethylamine; Aminoethanol; Colamine; Ethanolamine; 2-Amino-1-Ethanol; β-Ethanolamine; 2-Aminoethan-1-ol
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
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
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; Dimethylcarbinol; IPA; i-Propanol; i-Propylalkohol; iso-C3H7OH; Isopropanol; Isopropenol; Isopropyl Alcohol; Isopropyl alcohol, rubbing; Propan-2-ol; Propane, 2-hydroxy-; sec-Propanol; sec-Propyl Alcohol
124	H2OCH3OCH3	water dimethylether dimer	InChI=1S/C2H8O2/c1-4(2)5-3/h3H,1-2H3	WQDVWPNTHIBVKR-UHFFFAOYSA-N	COC.O
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
43625656	C3H9O+	trimethyl oxonium cation	InChI=1S/C3H9O/c1-4(2)3/h1-3H3/q+1		C[O+](C)C
96607237	FONO	Nitrosyl hypofluorite	InChI=1S/FNO2/c1-4-2-3	KIKPURRCWNPDFV-UHFFFAOYSA-N	FON=O
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
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
10022501	FNO2	Nitryl fluoride	InChI=1S/FNO2/c1-2(3)4	JVJQPDTXIALXOG-UHFFFAOYSA-N	F[N+]([O-])=O
7783440	FOOF	Perfluoroperoxide	InChI=1S/F2O2/c1-3-4-2	REAOZOPEJGPVCB-UHFFFAOYSA-N	FOOF
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
7783542	NF3+	Nitrogen trifluoride cation	InChI=1S/F3N/c1-4(2)3/q+1	GXSRSVIGHOUIDM-UHFFFAOYSA-N	F[N+](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- 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; 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
12265826	Li2F2	Lithium fluoride dimer	InChI=1S/2F.2Li		[Li]1F[Li]F1
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
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
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
353504	CF2O+	Carbonic difluoride cation	InChI=1S/CF2O/c2-1(3)4/q+1		[O][C+](F)F
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
9000913	NF3H+	protonated nitrogen trifluoride	InChI=1S/F3HN/c1-4(2)3/h4H/q+1	LJHPPYRGBOBCCR-UHFFFAOYSA-N	F[NH+](F)F
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; 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
1544463	CH2FCHO	Fluoroacetaldehyde	InChI=1S/C2H3FO/c3-1-2-4/h2H,1H2		O=CCF		2-Fluoroacetaldehyde; α-Fluoroacetaldehyde
1544463	CH2FCHO	Fluoroacetaldehyde	InChI=1S/C2H3FO/c3-1-2-4/h2H,1H2		O=CCF		2-Fluoroacetaldehyde; α-Fluoroacetaldehyde
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
371620	CH2FCH2OH	2-fluoroethanol	InChI=1S/C2H5FO/c3-1-2-4/h4H,1-2H2		OCCF
818928	CH2CHCH2F	Allyl Fluoride	InChI=1S/C3H5F/c1-2-3-4/h2H,1,3H2	QCMKXHXKNIOBBC-UHFFFAOYSA-N	C=CCF		3-Fluoropropene; 3-Fluoropropylene; 3-Fluoro-1-propene; 1-Fluoro-2-propene; Propene, 3-fluoro-
818928	CH2CHCH2F	Allyl Fluoride	InChI=1S/C3H5F/c1-2-3-4/h2H,1,3H2	QCMKXHXKNIOBBC-UHFFFAOYSA-N	C=CCF		3-Fluoropropene; 3-Fluoropropylene; 3-Fluoro-1-propene; 1-Fluoro-2-propene; Propene, 3-fluoro-
1184607	CH2CFCH3	2-fluoropropene	InChI=1S/C3H5F/c1-3(2)4/h1H2,2H3	NGOCAPPEAVAHQM-UHFFFAOYSA-N	C=C(F)C		1-Propene, 2-fluoro-; Propene, 2-fluoro-; 2-Fluoroprop-1-ene
20327655	CH3CHCHF	trans-1-Fluoro-1-propene	InChI=1S/C3H5F/c1-2-3-4/h2-3H,1H3/b3-2+	VJGCZWVJDRIHNC-NSCUHMNNSA-N	C/C=C/F		1-​Propene, 1-​fluoro-​, (1E)​-; Propene, 1-fluoro-, (E)-; (E)-1-Fluoro-1-propene; trans-1-Fluoropropene
460139	CH2FCH2CH3	1-Fluoropropane	InChI=1S/C3H7F/c1-2-3-4/h2-3H2,1H3	JRHNUZCXXOTJCA-UHFFFAOYSA-N	CCCF		Propane, 1-fluoro-; n-Propyl fluoride; Propyl fluoride
460139	CH2FCH2CH3	1-Fluoropropane	InChI=1S/C3H7F/c1-2-3-4/h2-3H2,1H3	JRHNUZCXXOTJCA-UHFFFAOYSA-N	CCCF		Propane, 1-fluoro-; n-Propyl fluoride; Propyl fluoride
420268	CH3CHFCH3	2-Fluoropropane	InChI=1S/C3H7F/c1-3(2)4/h3H,1-2H3	PRNZBCYBKGCOFI-UHFFFAOYSA-N	FC(C)C		Isopropyl fluoride; Propane, 2-fluoro-; PrF
1313606	Na2O2	disodium dioxide	InChI=1S/2Na.2O		[Na]1O[Na]O1		disodium peroxide
1313606	Na2O2	disodium dioxide	InChI=1S/2Na.O2/c;;1-2/q2*+1;-2				disodium peroxide
12285642	Na2F2	Sodium Fluoride Dimer	InChI=1S/2F.2Na		[Na]1F[Na]F1		Disodium difluoride; Sodium, di-​μ-​fluorodi-
75241	Al(CH3)3	trimethyl aluminum	InChI=1S/3CH3.Al/h3*1H3;	JLTRXTDYQLMHGR-UHFFFAOYSA-N	C[Al](C)C
21645512	H3AlO3	Aluminum hydroxide	InChI=1S/Al.3H2O/h;3*1H2/q+3;;;/p-3		O[Al](O)O
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
13862163	N(SiH3)3	trisilylamine	InChI=1S/H9NSi3/c2-1(3)4/h2-4H3		[SiH3]N([SiH3])[SiH3]
14835144	SiF3	Silicon trifluoride radical	InChI=1S/F3Si/c1-4(2)3	ATVLVRVBCRICNU-UHFFFAOYSA-N	F[Si](F)F		trifluorosilyl radical
14835144	SiF3+	Silicon trifluoride cation	InChI=1S/F3Si/c1-4(2)3/q+1	JEZAFBTUBXYEBO-UHFFFAOYSA-N	F[Si+](F)F
13465719	SiHF3	trifluorosilane	InChI=1S/F3HSi/c1-4(2)3/h4H	WPPVEXTUHHUEIV-UHFFFAOYSA-N	F[SiH](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
594092	P(CH3)3	trimethylphosphine	InChI=1S/C3H9P/c1-4(2)3/h1-3H3	YWWDBCBWQNCYNR-UHFFFAOYSA-N	CP(C)C		Phosphine, trimethyl-; Trimethylphosphorus
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--	Sulfate dianion	InChI=1S/O3S/c1-4(2)3/q-2		[O][S-2]([O])[O]		Sulfurous acid, ion(2-)
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
7446119	SO3+	Sulfur trioxide cation	InChI=1S/O3S/c1-4(2)3/q+1	OCAJGPLXGNEGFT-UHFFFAOYSA-N	[O][S+]([O])[O]
7446119	SO3+	Sulfur trioxide cation	InChI=1S/O3S/c1-4(2)3/q+1	OCAJGPLXGNEGFT-UHFFFAOYSA-N	[O][S+]([O])[O]
15644492	CS3--	Carbonotrithioate	InChI=1S/CH2S3/c2-1(3)4/h(H2,2,3,4)/p-2		S=C([S-])[S-]		Carbonotrithioate; Carbonic acid, trithio-, ion(2-); Thiocarbonate ion; Trithiocarbonate
19269853	S4	Sulfur tetramer	InChI=1S/S4/c1-2-4-3-1		S1SSS1
19269853	S4	Sulfur tetramer	InChI=1S/S4/c1-3-4-2		S=[S][S]=S
19269853	S4	Sulfur tetramer	InChI=1S/S4/c1-3-4-2		S=[S][S]=S
25474924	S2N2	Disulfur dinitride	InChI=1S/N2S2/c1-3-2-4-1	HGFWWXXKPBDJAH-UHFFFAOYNA-N	S1[N]S[N]1
104267223	HSO3	Hydroxysulfonyl radical	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
594081	H2CS3	thiocarbonic acid	InChI=1S/CH2S3/c2-1(3)4/h(H2,2,3,4)	HIZCIEIDIFGZSS-UHFFFAOYSA-N	S=C(S)S		Carbonotrithioic acid; Thioxanthic acid; Trithiocarbonic acid
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-; Sulourea; Thiocarbamide; Thiocarbonic acid diamide; Thiomocovina; Thiourea; Thiuronium; THU; Urea, 2-thio-; USAF ek-497; Tsizp 34; Urea, thio-; beta-Thiopseudourea
62555	CH3CSNH2	Ethanethioamide	InChI=1S/C2H5NS/c1-2(3)4/h1H3,(H2,3,4)	YUKQRDCYNOVPGJ-UHFFFAOYSA-N	S=C(N)C		thioacetamide; acetothioamide
67685	CH3SOCH3	Dimethyl sulfoxide	InChI=1S/C2H6OS/c1-4(2)3/h1-2H3	IAZDPXIOMUYVGZ-UHFFFAOYSA-N	C[S](C)=O		Dimethyl Sulfoxide; Dimethyl Sulphoxide; DMSO; Domoso; Dromisol; Methane, sulfinylbis-; Methyl sulfoxide; Methylsulfinylmethane; Sulfinylbis[Methane]; (methylsulfinyl)methane
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
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; 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
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); 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
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
16860994	S2F2	Thio-thionyl fluoride	InChI=1S/F2S2/c1-4(2)3	KBYVSSUWTLBZTB-UHFFFAOYSA-N	S=S(F)F
13709358	FSSF	Difluorodisulfane	InChI=1S/F2S2/c1-3-4-2	DKDSFVCSLPKNPV-UHFFFAOYSA-N	FSSF
13637837	ClO2F	Chloryl fluoride	InChI=1S/ClFO2/c2-1(3)4	YVRLYFHVJLYEHM-UHFFFAOYSA-N	FCl(=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
13932100	ClO3	Chlorine trioxide	InChI=1S/ClO3/c2-1(3)4		O=Cl(=O)=O
14720300	BClF2	Chlorodifluoroborane	InChI=1S/BClF2/c2-1(3)4	ARGRMFKYCQHOAU-UHFFFAOYSA-N	ClB(F)F		Boron chloride fluoride; Boron chloride difluoride; Borane, chlorodifluoro-
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
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
60646380	SSCl2	Thiothionyl chloride	InChI=1S/Cl2S2/c1-4(2)3		S=S(Cl)Cl
65283989	ClONO	chlorine nitrite	InChI=1S/ClNO2/c1-4-2-3	NXRVFVBNLWGOCL-UHFFFAOYSA-N	ClON=O		Nitrosyl hypochlorite; hypochlorous nitrous anhydride; chlorine nitrite
65283989	ClONO	chlorine nitrite	InChI=1S/ClNO2/c1-4-2-3	NXRVFVBNLWGOCL-UHFFFAOYSA-N	ClON=O		Nitrosyl hypochlorite; hypochlorous nitrous anhydride; chlorine nitrite
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; trichlorophosphane; tricholorphosphine
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
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
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
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
12292238	ClOOCl	Dichlorine dioxide	InChI=1S/Cl2O2/c1-3-4-2	MAYPHUUCLRDEAZ-UHFFFAOYSA-N	ClOOCl
12258989	Na2Cl2	Disodium dichloride	InChI=1S/2Cl.2Na	SJUGNKORWBGDHO-UHFFFAOYSA-N	[Na]1Cl[Na]Cl1		Sodium chloride; Sodium chloride dimer
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
10025679	ClSSCl	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
10294345	BCl3+	Boron Trichloride cation	InChI=1S/BCl3/c2-1(3)4/q+1		Cl[B+](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; Phosgen; Phosgene
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
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; Dichlorothioformaldehyde; Carbonothioyl dichloride
1691890	CF2Cl	difluorochloromethyl radical	InChI=1S/CClF2/c2-1(3)4	QPAXMPYBNSHKAK-UHFFFAOYSA-N	Cl[C](F)F		Chlorodifluoromethyl; Methyl, chlorodifluoro-
1691903	CFCl2	dichlorofluoromethyl radical	InChI=1S/CCl2F/c2-1(3)4		F[C](Cl)Cl		Fluorodichloromethyl radical; Methyl, dichlorofluoro-
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
865496	CDCl3	trichloromethane-d	InChI=1S/CHCl3/c2-1(3)4/h1H/i1D	HEDRZPFGACZZDS-MICDWDOJSA-N	ClC(Cl)Cl
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
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; R 20; R 20 (refrigerant); TCM; Trichloormethaan; Trichloromethane; Trichlormethan; Trichloroform; Triclorometano
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
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]
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-; 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)-; trans-1,2-Dichloroethene; trans-1,2-Dichloroethylene; trans-Acetylene dichloride; trans-Di-1,2-Chloroethylene; trans-Dichloroethylene; 1,2-dichloroethylene
2317911	C2H2ClF	1-chloro-1-fluoroethylene	1S/C2H2ClF/c1-2(3)4/h1H2	FPBWSPZHCJXUBL-UHFFFAOYSA-N	C=C(Cl)F		Ethylene, 1-chloro-1-fluoro-; Ethene, 1-chloro-1-fluoro-
2268317	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	InChI=1S/C2H2ClF/c3-1-2-4/h1-2H/b2-1-	MTKHTBWXSHYCGS-UPHRSURJSA-N	Cl/C=C\F		cis-1-chloro-2-fluoroethylene; ethene, 1-chloro-2-fluoro-, (Z)-; ethylene, 1-chloro-2-fluoro-, (Z)-
2268328	CHFCHCl	(E)-1-chloro-2-fluoroethene	InChI=1S/C2H2ClF/c3-1-2-4/h1-2H/b2-1+	MTKHTBWXSHYCGS-OWOJBTEDSA-N	Cl/C=C/F		ethene, 1-chloro-2-fluoro-, (E)-; trans-1-chloro-2-fluoroethylene; trans-1-fluoro-2-chloroethylene
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
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
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
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-; Ethylene chloride; Ethylene dichloride; Freon 150; 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-; Ethylene chloride; Ethylene dichloride; Freon 150; 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; 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
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
107073	CH2ClCH2OH	2-Chloroethanol	InChI=1S/C2H5ClO/c3-1-2-4/h4H,1-2H2	SZIFAVKTNFCBPC-UHFFFAOYSA-N	OCCCl		Ethanol, 2-chloro-; β-Chloroethanol; β-Chloroethyl alcohol; β-Hydroxyethyl chloride; Chloroethanol; Ethene, chlorohydrin; Ethylchlorohydrin; Ethylene chlorhydrin; Glycol monochlorohydrin; 2-Chloro-1-ethanol; 2-Chloroethyl alcohol; 2-Chloroethan-1-ol
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
9000912	CH2ClCH2OH2+	2-chloroethanol, protonated	InChI=1S/C2H5ClO/c3-1-2-4/h4H,1-2H2/p+1	SZIFAVKTNFCBPC-UHFFFAOYSA-O	[OH2+]CCCl
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
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
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
17014710	K2O2	dipotassium dioxide	InChI=1S/2K.2O		[K]1O[K]O1		Potassium peroxide; Dipotassium peroxide; Potassium oxide
17014710	K2O2	dipotassium dioxide	InChI=1S/2K.2O/q2*+1;2*-1		[K+]1[O-][K+][O-]1		Potassium peroxide; Dipotassium peroxide; Potassium oxide
13709472	ScF3	Scandium trifluoride	InChI=1S/3FH.Sc/h3*1H;/q;;;+3/p-3	OEKDNFRQVZLFBZ-UHFFFAOYSA-K	F[Sc](F)F		Scandium(III) Fluoride
7783519	GaF3	Gallium trifluoride	InChI=1S/3FH.Ga/h3*1H;/q;;;+3/p-3	WXXZSFJVAMRMPV-UHFFFAOYSA-K	F[Ga](F)F
13450903	GaCl3	Gallium trichloride	InChI=1S/3ClH.Ga/h3*1H;/q;;;+3/p-3	UPWPDUACHOATKO-UHFFFAOYSA-K	Cl[Ga](Cl)Cl
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; 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
9000917	AsF3H+	Arsenic trifluoride, protonated	InChI=1S/AsF3H/c2-1(3)4/h1H/q+1	JYNZVCFDFISIQT-UHFFFAOYSA-N	F[AsH+](F)F
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
7784330	AsBr3	Arsenic tribromide	InChI=1S/AsBr3/c2-1(3)4	JMBNQWNFNACVCB-UHFFFAOYSA-N	BrAs(Br)Br
7787715	BrF3	Bromine trifluoride	InChI=1S/BrF3/c2-1(3)4	FQFKTKUFHWNTBN-UHFFFAOYSA-N	FBr(F)F		Bromine fluoride; Bromine trifluoride
7727153	AlBr3	Aluminum Bromide	InChI=1S/Al.3BrH/h;3*1H/q+3;;;/p-3		Br[Al](Br)Br		aluminum tribromide
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
32062149	BrO3-	Bromate anion	InChI=1S/BrHO3/c2-1(3)4/h(H,2,3,4)/p-1		[O-]Br(=O)=O
593953	COBr2	Carbonic dibromide	InChI=1S/CBr2O/c2-1(3)4	MOIPGXQKZSZOQX-UHFFFAOYSA-N	O=C(Br)Br
4471185	CBr3	tribromomethyl radical	InChI=1S/CBr3/c2-1(3)4	ROWMQJJMCWDJDT-UHFFFAOYSA-N	Br[C](Br)Br
593986	CHFClBr	fluorochlorobromomethane	InChI=1S/CHBrClF/c2-1(3)4/h1H/t1-/m0/s1	YNKZSBSRKWVMEZ-SFOWXEAESA-N	Br[C@H](F)Cl		Bromochlorofluoromethane; Methane, bromochlorofluoro-
593986	CHFClBr	fluorochlorobromomethane	InChI=1S/CHBrClF/c2-1(3)4/h1H	YNKZSBSRKWVMEZ-UHFFFAOYSA-N	BrC(F)Cl		Bromochlorofluoromethane; Methane, bromochlorofluoro-
1868537	CHBr2F	dibromofluoromethane	InChI=1S/CHBr2F/c2-1(3)4/h1H	LTUTVFXOEGMHMP-UHFFFAOYSA-N	FC(Br)Br		Methane, dibromofluoro-
1511622	CHBrF2	Methane, bromodifluoro-	InChI=1S/CHBrF2/c2-1(3)4/h1H	GRCDJFHYVYUNHM-UHFFFAOYSA-N	BrC(F)F		Bromodifluoromethane; Difluorobromomethane
75274	CHBrCl2	Methane, bromodichloro-	InChI=1S/CHBrCl2/c2-1(3)4/h1H	FMWLUWPQPKEARP-UHFFFAOYSA-N	ClC(Br)Cl		Bromodichloromethane; Dichlorobromomethane; Dichloromonobromomethane; Monobromodichloromethane
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
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
593920	C2H2Br2	1,1-dibromoethene	InChI=1S/C2H2Br2/c1-2(3)4/h1H2	IWHJPYXAFGKABF-UHFFFAOYSA-N	C=C(Br)Br
590114	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	InChI=1S/C2H2Br2/c3-1-2-4/h1-2H/b2-1-	UWTUEMKLYAGTNQ-UPHRSURJSA-N	Br/C=C\Br		1,2-dibromoethylene
590125	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	InChI=1S/C2H2Br2/c3-1-2-4/h1-2H/b2-1+	UWTUEMKLYAGTNQ-OWOJBTEDSA-N	Br/C=C/Br		dibromoethene; dibromoethylene
107040	CH2BrCH2Cl	1-bromo-2-chloroethane	InChI=1S/C2H4BrCl/c3-1-2-4/h1-2H2	IBYHHJPAARCAIE-UHFFFAOYSA-N	BrCCCl		Ethylene chlorobromide; β-Chloroethyl bromide; 2-Bromoethyl chloride; 1,2-Chlorobromoethane
107040	CH2BrCH2Cl	1-bromo-2-chloroethane	InChI=1S/C2H4BrCl/c3-1-2-4/h1-2H2	IBYHHJPAARCAIE-UHFFFAOYSA-N	BrCCCl		Ethylene chlorobromide; β-Chloroethyl bromide; 2-Bromoethyl chloride; 1,2-Chlorobromoethane
106934	CH2BrCH2Br	Ethane, 1,2-dibromo-	InChI=1S/C2H4Br2/c3-1-2-4/h1-2H2	PAAZPARNPHGIKF-UHFFFAOYSA-N	BrCCBr		α,β-Dibromoethane; sym-Dibromoethane; Ethylene bromide; Ethylene dibromide; 1,2-Dibromoethane; Dibromoethane
106934	CH2BrCH2Br	Ethane, 1,2-dibromo-	InChI=1S/C2H4Br2/c3-1-2-4/h1-2H2	PAAZPARNPHGIKF-UHFFFAOYSA-N	BrCCBr		α,β-Dibromoethane; sym-Dibromoethane; Ethylene bromide; Ethylene dibromide; 1,2-Dibromoethane; Dibromoethane
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
10025919	SbCl3	Antimony Trichloride	InChI=1S/3ClH.Sb/h3*1H;/q;;;+3/p-3		Cl[Sb](Cl)Cl		Trichlorostibine; Antimonous chloride; Antimony(III) trichloride; Stibine, trichloro-
7783564	SbF3	Antimony Trifluoride	InChI=1S/3FH.Sb/h3*1H;/q;;;+3/p-3		F[Sb](F)F		Stibine, trifluoro-
13451188	TeO3	Tellurium trioxide	InChI=1S/O3Te/c1-4(2)3		O=[Te](=O)=O		Tellurium oxide
13455011	PI3	Phosphorus triiodide	InChI=1S/I3P/c1-4(2)3	PZHNNJXWQYFUTD-UHFFFAOYSA-N	IP(I)I
13444854	NI3	Nitrogen triiodide	InChI=1S/I3N/c1-4(2)3		IN(I)I		Nitrogen iodide
22520963	IF3	iodone trifluoride	InChI=1S/F3I/c1-4(2)3		FI(F)F
75478	CHI3	Iodoform	InChI=1S/CHI3/c2-1(3)4/h1H	OKJPEAGHQZHRQV-UHFFFAOYSA-N	IC(I)I		triiodomethane; Methane, triiodo-
594047	CHCl2I	dichloroiodomethane	InChI=1S/CHCl2I/c2-1(3)4/h1H	HNLZCOJXSLDGKD-UHFFFAOYSA-N	IC(Cl)Cl
1512283	CHFClI	fluorochloroiodomethane	InChI=1S/CHClFI/c2-1(3)4/h1H	HLSRAOHMHGINPN-UHFFFAOYSA-N	F[C@@H](I)Cl		chlorofluoroiodomethane
1493034	CHF2I	difluoroiodomethane	InChI=1S/CHF2I/c2-1(3)4/h1H	YSLFMGDEEXOKHF-UHFFFAOYSA-N	IC(F)F		Methane, difluoroiodo-; Iododifluoromethane
19624227	B5H9	pentaborane9	InChI=1S/B5H9/c6-1-5-2(6)8-4(5)9-3(5)7-1/h1-5H	USBVLEBZPMQADS-UHFFFAOYSA-N
21986038	C5H4	pentatetraene	InChI=1S/C5H4/c1-3-5-4-2/h1-2H2	UNSWNZFTRPSXHQ-UHFFFAOYSA-N	C=C=C=C=C		1,2,3,4-Pentatetraene
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
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
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
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
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
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
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
35634107	C5H6	Propellane	InChI=1S/C5H6/c1-4-2-5(1,4)3-4/h1-3H2	ZTXSPLGEGCABFL-UHFFFAOYSA-N	C1C23CC12C3		[1.1.1]Propellane; Tricyclo[1.1.1.0 1,​3]​pentane
35634107	C5H6	Propellane	InChI=1S/C5H6/c1-4-2-5(1,4)3-4/h1-3H2/t4-,5+		C1C23CC12C3		[1.1.1]Propellane; Tricyclo[1.1.1.0 1,​3]​pentane
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
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
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; beta-Methylbivinyl
142290	C5H8	Cyclopentene	InChI=1S/C5H8/c1-2-4-5-3-1/h1-2H,3-5H2	LPIQUOYDBNQMRZ-UHFFFAOYSA-N	C1=CCCC1		Cyclopentene
311751	C5H8	Bicyclo[1.1.1]pentane	InChI=1S/C5H8/c1-4-2-5(1)3-4/h4-5H,1-3H2	MKCBRYIXFFGIKN-UHFFFAOYSA-N	C1(C2)CC2C1
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
591968	C5H8	2,3-Pentadiene	InChI=1S/C5H8/c1-3-5-4-2/h3-4H,1-2H3/t5-/m1/s1	PODAMDNJNMAKAZ-RXMQYKEDSA-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
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
627214	CH3CCCH2CH3	2-Pentyne	InChI=1S/C5H8/c1-3-5-4-2/h3H2,1-2H3	NKTDTMONXHODTI-UHFFFAOYSA-N	CC#CCC		Ethylmethylacetylene; pent-2-yne
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
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
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
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
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; gamma-Isoamylene; 2-methylbut-1-ene
287923	C5H10	Cyclopentane	InChI=1S/C5H10/c1-2-4-5-3-1/h1-5H2	RGSFGYAAUTVSQA-UHFFFAOYSA-N	C1CCCC1		Cyclopentane; Pentamethylene
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; Trimethylethylene; alpha,eta-amylene; beta-Isoamylene
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
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
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
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
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
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; USAF KF-19; USAF a-4600
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
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
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
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
109751	CH2CHCH2CN	Allylcyanide	InChI=1S/C4H5N/c1-2-3-4-5/h2H,1,3H2		N#CCC=C		1-Butene-3-nitrile; 1-Propene-3-nitrile; 2-Propenyl cyanide; 3-Butenonitrile; 3-Butenylnitrile; 3-Cyano-1-propene; 3-Cyanopropene; Vinylacetonitrile; β-Butenonitrile
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
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
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
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
9000366	C4H5N	3H-pyrrole	InChI=1S/C4H5N/c1-2-4-5-3-1/h1,3-4H,2H2	VXIKDBJPBRMXBP-UHFFFAOYSA-N	N1=CCC=C1
9000377	C4H5N	2H-pyrrole	InChI=1S/C4H5N/c1-2-4-5-3-1/h1-3H,4H2	JZIBVTUXIVIFGC-UHFFFAOYSA-N	N1=CC=CC1
9000911	C4H6N+	pyrrole, protonated	InChI=1S/C4H5N/c1-2-4-5-3-1/h1-5H/p+1	KAESVJOAVNADME-UHFFFAOY	[NH2+]1C=CC=C1
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
910095135	C4H6N+	pyrrole, beta-protonated	InChI=1S/C4H5N/c1-2-4-5-3-1/h1,3-4H,2H2/p+1	VXIKDBJPBRMXBP-UHFFFAOYSA-O	[NH+]1=CCC=C1
910095204	C4H6N+	pyrrole, alpha-protonated	InChI=1S/C4H5N/c1-2-4-5-3-1/h1-3H,4H2/p+1	JZIBVTUXIVIFGC-UHFFFAOYSA-O	[NH+]1=CC=CC1
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
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-; 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
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; 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; 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; butan-1-amine
109897	NH(C2H5)2	diethylamine	InChI=1S/C4H11N/c1-3-5-4-2/h5H,3-4H2,1-2H3	HPNMFZURTQLUMO-UHFFFAOYSA-N	CCNCC		DEA; diethylamine
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)
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
1303862	B2O3	diboron trioxide	InChI=1S/B2O3/c3-1-5-2-4		O=BOB=O		Boron oxide (B2O3); Boracic anhydride; Boria
1303862	B2O3	diboron trioxide	InChI=1S/B2O3/c3-1-5-2-4		O=BOB=O		Boron oxide (B2O3); Boracic anhydride; Boria
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
122413358	ONONO	Nitrosyl nitrite	InChI=1S/N2O3/c3-1-5-2-4	SEOYNUHKXVGWFU-UHFFFAOYSA-N	O=NON=O
26404660	HOONO2	peroxy nitric acid	InChI=1S/HNO4/c2-1(3)5-4/h4H	UUZZMWZGAZGXSF-UHFFFAOYSA-N	OO[N+]([O-])=O
1588674	CHOOCHO	diformyl ether	InChI=1S/C2H2O3/c3-1-5-2-4/h1-2H		O=COC=O		Formic acid anhydride; Formic anhydride; formyl ether
1588674	CHOOCHO	diformyl ether	InChI=1S/C2H2O3/c3-1-5-2-4/h1-2H		O=COC=O		Formic acid anhydride; Formic anhydride; formyl ether
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; α-Ketoacetic acid; Formic acid, formyl-; Formylformic acid; Glyoxalic acid; Oxalaldehydic acid; Oxoacetic acid; Oxoethanoic acid; Acetic acid, oxo-; 2-oxoacetic acid
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
288426	C3H3NO	Oxazole	InChI=1S/C3H3NO/c1-2-5-3-4-1/h1-3H	ZCQWOFVYLHDMMC-UHFFFAOYSA-N	O1C=NC=C1		1,3-Oxazole; Oxazole
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
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
542789	C3H4O2	propanedial	InChI=1S/C3H4O2/c4-2-1-3-5/h2-3H,1H2	WSMYVTOQOOLQHP-UHFFFAOYSA-N	O=CCC=O		Malondialdehyde; 1,3-Propanedial; Malonaldehyde; Malonodialdehyde
1423605	CH3COCCH	3-butyn-2-one	InChI=1S/C4H4O/c1-3-4(2)5/h1H,2H3	XRGPFNGLRSIPSA-UHFFFAOYSA-N	CC(C#C)=O		Methyl ethynyl ketone; 1-Butyn-3-one; Ketone, ethynyl methyl; Ethynyl methyl ketone; Acetylacetylene; Acetylethyne; But-3-yn-2-one; 3-Butyne-2-one
6669369	C2H4O3	1,2,3-trioxolane	InChI=1S/C2H4O3/c1-2-4-5-3-1/h1-2H2	MAAKQSASDHJHIR-UHFFFAOYSA-N	O1OCCO1		molozonide
289145	C2H4O3	trioxolane124	InChI=1S/C2H4O3/c1-3-2-5-4-1/h1-2H2	RZYIPLSVRHWROD-UHFFFAOYSA-N	O1OCOC1		trioxolane; 1,2,4-Trioxolane
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; Oxacyclopentadiene; Oxole; Tetrole
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
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
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-; α-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; 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; α-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; α-Hydroxyacetic acid; Glycollic acid; Hydroxyethanoic acid; 2-Hydroxyacetic acid
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; Vinyl amide
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
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
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-
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
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; beta-Methyl acrolein; (E)-but-2-enal
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; Propanoic 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
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; 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; 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
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
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; 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; 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
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
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; Propanal, 2-methyl-; Propionaldehyde, 2-methyl-; Valine aldehyde; alpha-Methylpropionaldehyde
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; Vinyl ethyl ether, inhibited; Vinamar; Vinyl Ethyl ether
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; Oxacyclopentane; Oxolane; Tetrahydrofuraan; Tetrahydrofuran; Tetrahydrofuranne; Tetraidrofurano; Tetramethylene oxide; THF
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; Oxacyclopentane; Oxolane; Tetrahydrofuraan; Tetrahydrofuran; Tetrahydrofuranne; Tetraidrofurano; Tetramethylene oxide; THF
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
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; 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; ether
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
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
2919235	C4H8O	Cyclobutanol	InChI=1S/C4H8O/c5-4-2-1-3-4/h4-5H,1-3H2	KTHXBEHDVMTNOH-UHFFFAOYSA-N	OC1CCC1		Cyclobutanol; Cyclobutyl hydroxide
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
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
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-; ether; alpha-Methoxy propane
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
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-; t-Butanol; t-Butyl alchohol; t-Butyl hydroxide; tert-Butanol; tert-Butyl Alcohol; tert-Butyl hydroxide; tert-C4H9OH; Trimethylmethanol; Trimethylcarbinol
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-; t-Butanol; t-Butyl alchohol; t-Butyl hydroxide; tert-Butanol; tert-Butyl Alcohol; tert-Butyl hydroxide; tert-C4H9OH; Trimethylmethanol; Trimethylcarbinol
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; Solvent ether; 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
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
71363	C4H10O+	1-Butanol cation	InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3/q+1	LRHPLDYGYMQRHN-UHFFFAOYSA-N	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; 2-Butyl alcohol; s-Butyl alcohol; s-Butanol; 2-butanol
288379	C2H2N2O	Furazan	InChI=1S/C2H2N2O/c1-2-4-5-3-1/h1-2H	JKFAIQOWCVVSKC-UHFFFAOYSA-N	n1oncc1		1,2,5-Oxadiazole; Azoxazole; 1-Oxa-2,5-diazacyclopentadiene
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
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
7789266	FNO3	Fluorine nitrate	InChI=1S/FNO3/c1-5-2(3)4	VHFBTKQOIBRGQP-UHFFFAOYSA-N	ON(=O)=O		Fluorine nitrate; FONO2; hypofluorous nitric anhydride
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
1493114	CF3OH	trifluoromethanol	InChI=1S/CHF3O/c2-1(3,4)5/h5H	WZCZNEGTXVXAAS-UHFFFAOYSA-N	OC(F)(F)F		Trifluoromethyl alcohol; Perfluoromethanol
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
430660	CHF2CH2F	Ethane, 1,1,2-trifluoro	InChI=1S/C2H3F3/c3-1-2(4)5/h2H,1H2	WGZYQOSEVSXDNI-UHFFFAOYSA-N	FCC(F)F		1,1,2-Trifluoroethane
430660	CHF2CH2F	Ethane, 1,1,2-trifluoro	InChI=1S/C2H3F3/c3-1-2(4)5/h2H,1H2	WGZYQOSEVSXDNI-UHFFFAOYSA-N	FCC(F)F		1,1,2-Trifluoroethane
420451	CH3CF2CH3	2,2-difluoropropane	InChI=1S/C3H6F2/c1-3(2,4)5/h1-2H3		CC(F)(F)C		Propane, 2,​2-​difluoro-; HFC 272ca; R 272ca; Dimethyldifluoromethane
462395	CH2FCH2CH2F	1,3-difluoropropane	InChI=1S/C3H6F2/c4-2-1-3-5/h1-3H2	OOLOYCGJRJFTPM-UHFFFAOYSA-N	FCCCF
359013	CH3CHFCH2CH3	2-fluorobutane	InChI=1S/C4H9F/c1-3-4(2)5/h4H,3H2,1-2H3/t4-/m0/s1		C[C@H](F)CC		Butane, 2-fluoro-
359013	CH3CHFCH2CH3	2-fluorobutane	InChI=1S/C4H9F/c1-3-4(2)5/h4H,3H2,1-2H3	IXHWZHXLJJPXIS-UHFFFAOYSA-N			Butane, 2-fluoro-
2366521	C4H9F	1-fluorobutane	InChI=1S/C4H9F/c1-2-3-4-5/h2-4H2,1H3	FCBJLBCGHCTPAQ-UHFFFAOYSA-N	CCCCF		Butane, 1-fluoro-; n-butyl fluoride; n-fluorobutane
13709869	NH3BF3	Amminetrifluoroboron	InChI=1S/BF3H3N/c2-1(3,4)5/h5H3	KSFLLKZSRZJUQP-UHFFFAOYSA-N	[NH3+][B-](F)(F)F		Boron, amminetrifluoro-; Borane, trifluoro-, monoammoniate; Ammonia compd. with boron trifluoride (1:1)
695808812	MgCO3	Magnesium Carbonate	InChI=1S/CH2O3.Mg/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2	ZLNQQNXFFQJAID-UHFFFAOYSA-L	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; 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
110638169	PF3CH2	phosphorane, trifluoromethylene-	InChI=1S/CH2F3P/c1-5(2,3)4/h1H2	ZPUBUUGBPJEQTR-UHFFFAOYSA-N	C=P(F)(F)F
420520	CF3PH2	phosphine, (trifluoromethyl)-	InChI=1S/CH2F3P/c2-1(3,4)5/h5H2	QQAHNNMLPUNNNJ-UHFFFAOYSA-N	PC(F)(F)F
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		hydrogen sulfate
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; Vitriol, oil of; Zwavelzuuroplossingen
289065	C2H2N2S	1,3,4-Thiadiazole	InChI=1S/C2H2N2S/c1-3-4-2-5-1/h1-2H		S1C=NN=C1		Thiadiazole; 1-Thia-3,4-diazacyclopentadiene; 3,4-Diazathiophene
288471	C3H3NS	Thiazole	InChI=1S/C3H3NS/c1-2-5-3-4-1/h1-3H	FZWLAAWBMGSTSO-UHFFFAOYSA-N	S1C=NC=C1
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
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; Semicarbazide, 3-thio-; Semicarbazide, thio-; Thiocarbamoylhydrazine; Thiocarbamylhydrazine; Thiosemicarbazide; TSC; TSZ; USAF ek-1275
3144090	CH3SO2NH2	methanesulfonamide	InChI=1S/CH5NO2S/c1-5(2,3)4/h1H3,(H2,2,3,4)	HNQIVZYLYMDVSB-UHFFFAOYSA-N	CS(N)(=O)=O		Methylsulfonamide; methanesulphonamide; Mesylamide; Methanesulfonic amide
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
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-
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
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
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
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
109795	C4H9SH	1-Butanethiol	InChI=1S/C4H10S/c1-2-3-4-5/h5H,2-4H2,1H3	WQAQPCDUOCURKW-UHFFFAOYSA-N	SCCCC		Butyl mercaptan; 1-butylthiol; Butanethiol; n-Butanethiol; n-Butyl mercaptan; 1-Butyl mercaptan; butane-1-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; diethylsulfane
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 thioalcohol; sec-Butyl thiol; sec-C4H9SH; Secondary butylmercaptan; butane-2-thiol
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
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; 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; 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-; 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
13451086	SCl4	Sulfur tetrachloride	InChI=1S/Cl4S/c1-5(2,3)4		ClS(Cl)(Cl)Cl
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; perchlorosilane
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
14545723	ClONO2	Chlorine nitrate	InChI=1S/ClNO3/c1-5-2(3)4	XYLGPCWDPLOBGP-UHFFFAOYSA-N	ClO[N]([O])=O
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
30708806	ClOF3	Chlorine trifluoride oxide	InChI=1S/ClF3O/c2-1(3,4)5	QPKQQPNQDSQNHS-UHFFFAOYSA-N	O=Cl(F)(F)F		Chlorine fluoride oxide; Chlorine oxide trifluoride; trifluoro(oxo)-λ5-chlorane
75694	CFCl3	Trichloromonofluoromethane	InChI=1S/CCl3F/c2-1(3,4)5	CYRMSUTZVYGINF-UHFFFAOYSA-N	ClC(Cl)(Cl)F		Chlorofluoromethane (CCl3F); Fluorocarbon 11; Fluorochloroform; Fluorotrichloromethane; Freon 11; Methane, trichlorofluoro-; Monofluorotrichloromethane; 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; Refrigerant 12; Ucon 12; Ucon 12/halocarbon 12
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; Trifluorochloromethane; Trifluoromonochlorocarbon
56235	CCl4	Carbon tetrachloride	InChI=1S/CCl4/c2-1(3,4)5	VZGDMQKNWNREIO-UHFFFAOYSA-N	ClC(Cl)(Cl)Cl		Benzenoform; Carbon tet; Carbon Tetrachloride; Freon 10; Methane tetrachloride; Methane, tetrachloro-; Perchloromethane; Tetrachloromethane
56235	CCl4+	Carbon tetrachloride cation	InChI=1S/CCl4/c2-1(3,4)5/q+1	UFDGKDLVCPGDGN-UHFFFAOYSA-N	ClC(Cl)([Cl+])Cl
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; Ethene, trichloro-; Ethinyl trichloride; Ethylene trichloride; Ethylene, trichloro-; TCE; Trichloroethene; Trichloroethylene; Tricloroetilene; Trichloraethen; Trichlorethene; Trilen; Vitran
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
25523142	CHCl2CCH	3,3-dichloropropyne	InChI=1S/C3H2Cl2/c1-2-3(4)5/h1,3H		C#CC(Cl)Cl		Propyne, 3,3-dichloro-
83682320	CHClCCHCl	1,3-dichloroallene	InChI=1S/C3H2Cl2/c4-2-1-3-5/h2-3H/t1-/m1/s1		ClC=C=CCl		dichloroallene
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; α,α-Dichloroacetaldehyde
927753	CH2ClCCCl	1,3-dichloropropyne	InChI=1S/C3H2Cl2/c4-2-1-3-5/h2H2		ClC#CCCl
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
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
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
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-
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; 1-chloro-1,1-difluoroethane
71556	CH3CCl3	Ethane, 1,1,1-trichloro-	InChI=1S/C2H3Cl3/c1-2(3,4)5/h1H3	UOCLXMDMGBRAIB-UHFFFAOYSA-N	CC(Cl)(Cl)Cl		α-Trichloroethane; 1,1,1-TCE; 1,1,1-Trichloroethane; Ethane, 1,1,1-trichloro-; Methylchloroform; Methyltrichloromethane; Trichloro-1,1,1-ethane; Trichloromethylmethane; Trichloroethane; alpha-Trichloroethane
49860186	NH3BCl3	Amminetrichloroboron	InChI=1S/BCl3H3N/c2-1(3,4)5/h5H3		[NH3+][B-](Cl)(Cl)Cl		Boron, amminetrichloro-; Borane, trichloro-, monoammoniate; Trichloroborane monoammoniate; Trichloroborane, compd. with ammonia (1:1)
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-; SKEkhG; alpha-Epichlorohydrin; gamma-Chloropropylene oxide
126998	CH2CClCHCH2	1,3-Butadiene, 2-chloro-	InChI=1S/C4H5Cl/c1-3-4(2)5/h3H,1-2H2	YACLQRRMGMJLJV-UHFFFAOYSA-N	C=C(Cl)C=C		Chloroprene; 2-Chloro-1,3-butadiene; 2-Chlorobutadiene; 2-Chlorobuta-1,3-diene; β-Chloroprene
142289	CH2ClCH2CH2Cl	1,3-dichloropropane	InChI=1S/C3H6Cl2/c4-2-1-3-5/h1-3H2	YHRUOJUYPBUZOS-UHFFFAOYSA-N	ClCCCCl		Trimethylene dichloride; Propane, 1,3-dichloro-
75785	SiCl2(CH3)2	dichlorodimethylsilane	InChI=1S/C2H6Cl2Si/c1-5(2,3)4/h1-2H3	LIKFHECYJZWXFJ-UHFFFAOYSA-N	C[Si](C)(Cl)Cl		Silane, dichlorodimethyl-; Dichlorodimethylsilicon; Dimethylsilane dichloride
78999	CHCl2CH2CH3	1,1-dichloropropane	InChI=1S/C3H6Cl2/c1-2-3(4)5/h3H,2H2,1H3		CCC(Cl)Cl		Propane, 1,​1-​dichloro-; Propylidene chloride
78999	CHCl2CH2CH3	1,1-dichloropropane	InChI=1S/C3H6Cl2/c1-2-3(4)5/h3H,2H2,1H3		CCC(Cl)Cl		Propane, 1,​1-​dichloro-; Propylidene chloride
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; Nemex; Propane, 1,2-dichloro-; Propylene chloride; Propylene dichloride; 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
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
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
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; n-Propylcarbinyl chloride; Sure Shot
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
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
288051	C4H4Se	selenophene	InChI=1S/C4H4Se/c1-2-4-5-3-1/h1-4H	MABNMNVCOAICNO-UHFFFAOYSA-N	[Se]1C=CC=C1		selenofuran
13465662	SeF4	Selenium tetrafluoride	InChI=1S/F4Se/c1-5(2,3)4	PMOBWAXBGUSOPS-UHFFFAOYSA-N	F[Se](F)(F)F		tetrafluoroselenium
13450925	GeBr4	Germanium tetrabromide	InChI=1S/Br4Ge/c1-5(2,3)4		Br[Ge](Br)(Br)Br
7789664	SiBr4	Silicon tetrabromide	InChI=1S/Br4Si/c1-5(2,3)4	AIFMYMZGQVTROK-UHFFFAOYSA-N	Br[Si](Br)(Br)Br
40423141	BrONO2	Bromine nitrate	InChI=1S/BrNO3/c1-5-2(3)4	RRTWEEAEXPZMPY-UHFFFAOYSA-N	[O]N([O])OBr
353548	CFBr3	fluorotribromomethane	InChI=1S/CBr3F/c2-1(3,4)5	IHZAEIHJPNTART-UHFFFAOYSA-N	FC(Br)(Br)Br		Tribromofluoromethane
353559	CBr2ClF	dibromochlorofluoromethane	InChI=1S/CBr2ClF/c2-1(3,4)5	HEDKQVNHJZBFQR-UHFFFAOYSA-N	FC(Br)(Br)Cl		Chloro dibromo fluoro methane; Chlorodibromofluoromethane
353582	CBrCl2F	bromodichlorofluoromethane	1S/CBrCl2F/c2-1(3,4)5	ARBYBCHKMDUXNE-UHFFFAOYSA-N	FC(Cl)(Cl)Br		Fluorodichlorobromomethane
353593	CBrClF2	Methane, bromochlorodifluoro-	InChI=1S/CBrClF2/c2-1(3,4)5	MEXUFEQDCXZEON-UHFFFAOYSA-N	FC(Br)(Cl)F		Bromochlorodifluoromethane; Difluorochlorobromomethane; Chlorodifluoromonobromomethane; Chlorodifluorobromomethane; Chlorobromodifluoromethane; Halon-1211
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; bromotrifluoromethane
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
594150	CBr3Cl	tribromochloromethane	InChI=1S/CBr3Cl/c2-1(3,4)5	GKXZMEXQUWZGJK-UHFFFAOYSA-N	ClC(Br)(Br)Br		Methane, tribromochloro-
594183	CBr2Cl2	dibromodichloromethane	InChI=1S/CBr2Cl2/c2-1(3,4)5	IHUREIPXVFKEDT-UHFFFAOYSA-N	ClC(Br)(Br)Cl		Methane, dibromodichloro-; Carbon dibromide dichloride
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-
594229	CCl3I	trichloroiodomethane	InChI=1S/CCl3I/c2-1(3,4)5	SFLKZLQXODICBP-UHFFFAOYSA-N	IC(Cl)(Cl)Cl
594230	CCl2I2	dichlorodiiodomethane	InChI=1S/CCl2I2/c2-1(3,4)5	ZOWYTDVMTPRWGU-UHFFFAOYSA-N	ClC(I)(I)Cl
1184765	CF2I2	difluorodiiodomethane	InChI=1S/CF2I2/c2-1(3,4)5		FC(I)(I)F		Diiododifluoromethane
753651	CFClBrI	fluorochlorobromoiodomethane	InChI=1S/CBrClFI/c2-1(3,4)5	XEGUVFFZWHRVAV-UHFFFAOYSA-N	F[C@](Br)(I)Cl		bromochlorofluoroiodomethane
507255	CI4	tetraiodomethane	InChI=1S/CI4/c2-1(3,4)5	JOHCVVJGGSABQY-UHFFFAOYSA-N	IC(I)(I)I		Carbon tetraiodide
14349805	CBr3I	tribromoiododmethane	InChI=1S/CBr3I/c2-1(3,4)5	JWCWGHDHZXYEGQ-UHFFFAOYSA-N	IC(Br)(Br)Br		methane, tribromoiodo-
13465844	SiI4	silicon tetraiodide	InChI=1S/I4Si/c1-5(2,3)4		I[Si](I)(I)I		Tetraiodosilane; Silane, tetraiodo-
13709610	XeF4	Xenon tetrafluoride	InChI=1S/F4Xe/c1-5(2,3)4		F[Xe](F)(F)F
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
5649956	C6H6	Dewar Benzene	InChI=1S/C6H6/c1-2-6-4-3-5(1)6/h1-6H	CTLSARLLLBZBRV-UHFFFAOYSA-N	[C@@H]12[C@H](C=C2)C=C1		Bicyclo[2.2.0]hexa-2,5-diene
5649956	C6H6	Dewar Benzene	InChI=1S/C6H6/c1-2-6-4-3-5(1)6/h1-6H/t5-,6+		[C@@H]1(C=C2)[C@H]2C=C1		Bicyclo[2.2.0]hexa-2,5-diene
5291907	C6H6	3,4-Dimethylenecyclobutene					Cyclobutene, 3,4-dimethylene-; 3,4-Bis(methylene)cyclobutene; 3,4-Dimethylenecyclobut-1-ene; Dimethylenecyclobutene
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
650420	C6H6	Prismane	InChI=1S/C6H6/c1-2-3(1)6-4(1)5(2)6/h1-6H/t1-,2+,3-,4+,5-,6+		[C@H]12[C@@H]3[C@H]1[C@@H]4[C@H]2[C@H]34		Tetracyclo[2.2.0.02,6.03,5]hexane; Ladenburg benzene
659858	C6H6	Benzvalene	InChI=1S/C6H6/c1-2-4-5-3(1)6(4)5/h1-6H/t3-,4+,5-,6+	VMQPMGHYRISRHO-FBXFSONDSA-N	[C@@H]12C=C[C@H]3[C@@H]1[C@@H]23		Tricyclo[3.1.0.02,6]hex-​3-​ene; Tricyclo[2.1.1.05,6]hex-2-ene
659858	C6H6	Benzvalene	InChI=1S/C6H6/c1-2-4-5-3(1)6(4)5/h1-6H/t3-,4+,5+,6-		[C@@H]12[C@H]3[C@H]1C=C[C@H]23		Tricyclo[3.1.0.02,6]hex-​3-​ene; Tricyclo[2.1.1.05,6]hex-2-ene
659858	C6H6	Benzvalene	InChI=1S/C6H6/c1-2-4-5-3(1)6(4)5/h1-6H	VMQPMGHYRISRHO-UHFFFAOYSA-N	C1=CC2C3C1C23		Tricyclo[3.1.0.02,6]hex-​3-​ene; Tricyclo[2.1.1.05,6]hex-2-ene
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; Nitration benzene; Phene; Phenyl hydride; Pyrobenzol; Pyrobenzole
71432	C6H6+	Benzene cation	InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H/q+1	HAIIYTFJFNJWGT-UHFFFAOYSA-N
71432	C6H6+	Benzene cation	InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H/q+1	HAIIYTFJFNJWGT-UHFFFAOYSA-N	[CH+]1C=C[CH]C=C
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
12169674	C6H7+	benzene, protonated	InChI=1S/C6H7/c1-2-4-6-5-3-1/h1-5H,6H2/q+1	YYBBWTWVCKKUGB-UHFFFAOYSA-N	C1C=C[CH+]C=C1
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
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
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
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
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
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
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
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
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
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
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
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; 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	1,1-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	1,1-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
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
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
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
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
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
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
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
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-
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
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
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; n-Hexane; Skellysolve B
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		An error occurred on the server when processing the URL. Please contact the system administrator. If you are the system administrator please click here to find out more about this error.