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N-[[3-keto-1-[(phenylthio)methyl]cyclohexyl]methyl]acetamide
SpectraBase Compound ID 2jN5pjM3RSb
InChI InChI=1S/C16H21NO2S/c1-13(18)17-11-16(9-5-6-14(19)10-16)12-20-15-7-3-2-4-8-15/h2-4,7-8H,5-6,9-12H2,1H3,(H,17,18)
InChIKey KWCCVAZWZJVAEI-UHFFFAOYSA-N
Mol Weight 291.41 g/mol
Molecular Formula C16H21NO2S
Exact Mass 291.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NHBtu0cY6X
Name N-[[3-keto-1-[(phenylthio)methyl]cyclohexyl]methyl]acetamide
Alternate Name(s) N-[[3-oxidanylidene-1-(phenylsulfanylmethyl)cyclohexyl]methyl]ethanamide N-[[3-oxo-1-[(phenylthio)methyl]cyclohexyl]methyl]acetamide
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Formula C16H21NO2S
InChI InChI=1S/C16H21NO2S/c1-13(18)17-11-16(9-5-6-14(19)10-16)12-20-15-7-3-2-4-8-15/h2-4,7-8H,5-6,9-12H2,1H3,(H,17,18)
InChIKey KWCCVAZWZJVAEI-UHFFFAOYSA-N
Molecular Weight 291.409 g/mol
SMILES N(C(=O)C)CC1(CC(=O)CCC1)CSc1ccccc1
SPLASH splash10-001i-9640000000-0c1547ff2c7e09092e4f
Source of Spectrum J-61-4639-4
Wiley ID 1294545