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2-(4-Methylphenyl)sulfanylethanamide
SpectraBase Compound ID 2RUzdP4TpOq
InChI InChI=1S/C9H11NOS/c1-7-2-4-8(5-3-7)12-6-9(10)11/h2-5H,6H2,1H3,(H2,10,11)
InChIKey OUXWFAJIPHIEII-UHFFFAOYSA-N
Mol Weight 181.25 g/mol
Molecular Formula C9H11NOS
Exact Mass 181.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1JJsmBdjK0
Name 2-(4-Methylphenyl)sulfanylethanamide
Alternate Name(s) 2-(p-tolylsulfanyl)acetamide 2-(p-tolylthio)acetamide 2-[(4-Methylphenyl)sulfanyl]acetamide 2-[(4-Methylphenyl)thio]acetamide
Comments Less than 3 mono-isotopic peaks
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Formula C9H11NOS
InChI InChI=1S/C9H11NOS/c1-7-2-4-8(5-3-7)12-6-9(10)11/h2-5H,6H2,1H3,(H2,10,11)
InChIKey OUXWFAJIPHIEII-UHFFFAOYSA-N
Molecular Weight 181.253 g/mol
SMILES NC(=O)CSc1ccc(cc1)C
SPLASH splash10-001r-0900000000-527f8a90f66adb2d0457
Source of Spectrum F-50-4966-11
Wiley ID 1177336