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2-keto-4-(methylthio)-6-(p-tolyl)pyran-3-carbonitrile
SpectraBase Compound ID CjBVWkZixcM
InChI InChI=1S/C14H11NO2S/c1-9-3-5-10(6-4-9)12-7-13(18-2)11(8-15)14(16)17-12/h3-7H,1-2H3
InChIKey HJBWBXRSRQEPRF-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C14H11NO2S
Exact Mass 257.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GoGYLExrd0
Name 2-keto-4-(methylthio)-6-(p-tolyl)pyran-3-carbonitrile
Alternate Name(s) 4-Methylsulfanyl-2-oxo-6-(p-tolyl)pyran-3-carbonitrile 6-(4-Methylphenyl)-4-(methylthio)-2-oxo-3-pyrancarbonitrile 6-(4-Methylphenyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile 6-(4-Methylphenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile
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Formula C14H11NO2S
InChI InChI=1S/C14H11NO2S/c1-9-3-5-10(6-4-9)12-7-13(18-2)11(8-15)14(16)17-12/h3-7H,1-2H3
InChIKey HJBWBXRSRQEPRF-UHFFFAOYSA-N
Molecular Weight 257.307 g/mol
SMILES C=1(C(OC(=CC1SC)c1ccc(C)cc1)=O)C#N
SPLASH splash10-0ar0-1390000000-2b84b905adfc0158386d
Source of Spectrum Y1-36-874-8
Wiley ID 1527145