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4,6-Dimethyl-2-(2-oxo-2-p-tolyl-ethylsulfanyl)-nicotinamide
SpectraBase Compound ID H09DngLLus0
InChI InChI=1S/C17H18N2O2S/c1-10-4-6-13(7-5-10)14(20)9-22-17-15(16(18)21)11(2)8-12(3)19-17/h4-8H,9H2,1-3H3,(H2,18,21)
InChIKey MWMAPEHVMCKGKF-UHFFFAOYSA-N
Mol Weight 314.4 g/mol
Molecular Formula C17H18N2O2S
Exact Mass 314.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JN0j0g57fyP
Name 4,6-Dimethyl-2-(2-oxo-2-p-tolyl-ethylsulfanyl)-nicotinamide
Alternate Name(s) 2-[[2-keto-2-(p-tolyl)ethyl]thio]-4,6-dimethyl-nicotinamide 4,6-Dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxamide 4,6-Dimethyl-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3-carboxamide 4,6-Dimethyl-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-pyridine-3-carboxamide 4,6-Dimethyl-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-3-pyridinecarboxamide
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Formula C17H18N2O2S
InChI InChI=1S/C17H18N2O2S/c1-10-4-6-13(7-5-10)14(20)9-22-17-15(16(18)21)11(2)8-12(3)19-17/h4-8H,9H2,1-3H3,(H2,18,21)
InChIKey MWMAPEHVMCKGKF-UHFFFAOYSA-N
Molecular Weight 314.403 g/mol
SMILES NC(c1c(nc(cc1C)C)SCC(c1ccc(cc1)C)=O)=O
SPLASH splash10-014i-3900000000-8fc8bace72a4f5894d7f
Wiley ID 1465448