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4,6-DIHYDRO-5-TOSYL-(1,3)-DITHIOLO-[4,5-C]-PYRROLE-2-ONE
SpectraBase Compound ID KPzC6Ll6gva
InChI InChI=1S/C12H11NO3S3/c1-8-2-4-9(5-3-8)19(15,16)13-6-10-11(7-13)18-12(14)17-10/h2-5H,6-7H2,1H3
InChIKey CMFQHTYWPKQFMQ-UHFFFAOYSA-N
Mol Weight 313.4 g/mol
Molecular Formula C12H11NO3S3
Exact Mass 312.990107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sfnE1GYj0f
Name 4,6-Dihydro-N-tosyl-[1,3]dithiolo[4,5-c]pyrrole-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H11NO3S3
InChI InChI=1S/C12H11NO3S3/c1-8-2-4-9(5-3-8)19(15,16)13-6-10-11(7-13)18-12(14)17-10/h2-5H,6-7H2,1H3
InChIKey CMFQHTYWPKQFMQ-UHFFFAOYSA-N
Molecular Weight 313.404 g/mol
SMILES C1N(CC2=C1SC(S2)=O)S(=O)(=O)c1ccc(C)cc1
SPLASH splash10-0a4i-0901000000-bd05bf7cfdffc6f030e7
Source of Spectrum J-65-5800-15
Synonyms 5-[(4-methylphenyl)sulfonyl]-5,6-dihydro-4H-[1,3]dithiolo[4,5-c]pyrrol-2-one 5-(p-tolylsulfonyl)-4,6-dihydro-[1,3]dithiolo[4,5-c]pyrrol-2-one 5-(4-methylphenyl)sulfonyl-4,6-dihydro-[1,3]dithiolo[4,5-c]pyrrol-2-one
Wiley ID 1533063