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1,5-Cyclohexadiene-1-carboxylic acid, 3-(4-chloro-5H-1,2,3-dithiazol-5-yliden)-4-oxo-, methyl ester
SpectraBase Compound ID 6jbOS5WuNl4
InChI InChI=1S/C10H6ClNO3S2/c1-15-10(14)5-2-3-7(13)6(4-5)8-9(11)12-17-16-8/h2-4H,1H3/b8-6-
InChIKey WDEILBHFZUQGNA-VURMDHGXSA-N
Mol Weight 287.74 g/mol
Molecular Formula C10H6ClNO3S2
Exact Mass 286.947763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJyI5IlPBe1
Name 1,5-Cyclohexadiene-1-carboxylic acid, 3-(4-chloro-5H-1,2,3-dithiazol-5-yliden)-4-oxo-, methyl ester
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Formula C10H6ClNO3S2
InChI InChI=1S/C10H6ClNO3S2/c1-15-10(14)5-2-3-7(13)6(4-5)8-9(11)12-17-16-8/h2-4H,1H3/b8-6-
InChIKey WDEILBHFZUQGNA-VURMDHGXSA-N
Molecular Weight 287.735 g/mol
SMILES C=1\C(=C/2C(=NSS2)Cl)C(C=CC1C(=O)OC)=O
SPLASH splash10-0udi-6690000000-bec646fc8999652237f9
Source of Spectrum IY-2-4975-2
Synonyms Methyl 3-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-4-oxocyclohexa-1,5-diene-1-carboxylate (3Z)-3-(4-chloro-5-dithiazolylidene)-4-oxo-1-cyclohexa-1,5-dienecarboxylic acid methyl ester Methyl (3Z)-3-(4-chlorodithiazol-5-ylidene)-4-oxocyclohexa-1,5-diene-1-carboxylate Methyl (3Z)-3-(4-chlorodithiazol-5-ylidene)-4-oxo-cyclohexa-1,5-diene-1-carboxylate Methyl (3Z)-3-(4-chloranyl-1,2,3-dithiazol-5-ylidene)-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylate
Wiley ID 1657735