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2-Methylsulfanyl-3-phenyl-3H-4,5-dihydro-1,3-benzodiazepine-4-thione
SpectraBase Compound ID Hx0jEa26cOK
InChI InChI=1S/C16H14N2S2/c1-20-16-17-14-10-6-5-7-12(14)11-15(19)18(16)13-8-3-2-4-9-13/h2-10H,11H2,1H3
InChIKey BRKLILIOYJIYLL-UHFFFAOYSA-N
Mol Weight 298.42 g/mol
Molecular Formula C16H14N2S2
Exact Mass 298.059841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GlEcIZnEcq6
Name 2-Methylsulfanyl-3-phenyl-3H-4,5-dihydro-1,3-benzodiazepine-4-thione
Comments Less than 3 mono-isotopic peaks
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Formula C16H14N2S2
InChI InChI=1S/C16H14N2S2/c1-20-16-17-14-10-6-5-7-12(14)11-15(19)18(16)13-8-3-2-4-9-13/h2-10H,11H2,1H3
InChIKey BRKLILIOYJIYLL-UHFFFAOYSA-N
Molecular Weight 298.422 g/mol
SMILES C=1(N(C(Cc2ccccc2N1)=S)c1ccccc1)SC
SPLASH splash10-0udj-0090000000-13e54aa559c4dee0be54
Source of Spectrum F4-42-291-8a
Wiley ID 1673557