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3-Methylthioacetaminophen
SpectraBase Compound ID 4nTAc2BOrNJ
InChI InChI=1S/C9H11NO2S/c1-6(11)10-8-4-3-7(12)5-9(8)13-2/h3-5,12H,1-2H3,(H,10,11)
InChIKey HAFOQKKHPICOLS-UHFFFAOYSA-N
Mol Weight 197.25 g/mol
Molecular Formula C9H11NO2S
Exact Mass 197.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8SbDuyWfNo
Name 3-Methylthioacetaminophen
Alternate Name(s) N-[4-hydroxy-2-(methylsulfanyl)phenyl]acetamide N-(4-hydroxy-2-methylsulfanylphenyl)acetamide N-(4-hydroxy-2-methylsulfanyl-phenyl)acetamide N-(2-methylsulfanyl-4-oxidanyl-phenyl)ethanamide
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Formula C9H11NO2S
InChI InChI=1S/C9H11NO2S/c1-6(11)10-8-4-3-7(12)5-9(8)13-2/h3-5,12H,1-2H3,(H,10,11)
InChIKey HAFOQKKHPICOLS-UHFFFAOYSA-N
Molecular Weight 197.252 g/mol
SMILES N(c1ccc(cc1SC)O)C(=O)C
SPLASH splash10-052g-2900000000-f2025407c63411c32e21
Source of Spectrum KO-8-148-1
Wiley ID 1194310