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3-Thiophenecarbothioamide, N-(4-bromophenyl)-2,5-dimethyl-
SpectraBase Compound ID 5WJ90ztVv2c
InChI InChI=1S/C13H12BrNS2/c1-8-7-12(9(2)17-8)13(16)15-11-5-3-10(14)4-6-11/h3-7H,1-2H3,(H,15,16)
InChIKey BBTUZROWSCRQRB-UHFFFAOYSA-N
Mol Weight 326.27 g/mol
Molecular Formula C13H12BrNS2
Exact Mass 324.959455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fz5k0VIl9f
Name 3-Thiophenecarbothioamide, N-(4-bromophenyl)-2,5-dimethyl-
CAS Registry Number 107366-79-0
Comments Less than 3 mono-isotopic peaks
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Formula C13H12BrNS2
InChI InChI=1S/C13H12BrNS2/c1-8-7-12(9(2)17-8)13(16)15-11-5-3-10(14)4-6-11/h3-7H,1-2H3,(H,15,16)
InChIKey BBTUZROWSCRQRB-UHFFFAOYSA-N
Molecular Weight 326.270 g/mol
SMILES N(C(c1c(sc(c1)C)C)=S)c1ccc(cc1)Br
SPLASH splash10-0a6r-0906000000-5a82738b425457b35e41
Source of Spectrum F-42-3686-0
Synonyms 3-(p-bromophenyl)amino-thixo-2,5-dimethyl-thiophene N-(4-bromophenyl)-2,5-dimethyl-3-thiophenecarbothioamide
Wiley ID 1323826