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3-([(4-Chlorophenyl)sulfinyl]methyl)-2-thiophenecarbothioamide
SpectraBase Compound ID Inih37dF0pH
InChI InChI=1S/C12H10ClNOS3/c13-9-1-3-10(4-2-9)18(15)7-8-5-6-17-11(8)12(14)16/h1-6H,7H2,(H2,14,16)
InChIKey RYIBWHIJCPLNTJ-UHFFFAOYSA-N
Mol Weight 315.85 g/mol
Molecular Formula C12H10ClNOS3
Exact Mass 314.961305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uCyi8KcaPa
Name 3-([(4-Chlorophenyl)sulfinyl]methyl)-2-thiophenecarbothioamide
CAS Registry Number 254982-00-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10ClNOS3
InChI InChI=1S/C12H10ClNOS3/c13-9-1-3-10(4-2-9)18(15)7-8-5-6-17-11(8)12(14)16/h1-6H,7H2,(H2,14,16)
InChIKey RYIBWHIJCPLNTJ-UHFFFAOYSA-N
Molecular Weight 315.851 g/mol
SMILES NC(c1c(CS(c2ccc(Cl)cc2)=O)ccs1)=S
SPLASH splash10-05fr-3900000000-0f1eb3e9569610154c1b
Source of Spectrum AD-0-2532-0
Synonyms 3-[(4-chlorophenyl)sulfinylmethyl]thiophene-2-carbothioamide Thiophene-2-carbothioamide, 3-(4-chlorophenylsulfinylmethyl)-
Wiley ID 1427518