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6-Methyl-5-methylthio-2-(4-cyanophenyl)-2,3-dihydro-4-pyrone
SpectraBase Compound ID GtsH2H5QTTj
InChI InChI=1S/C14H13NO2S/c1-9-14(18-2)12(16)7-13(17-9)11-5-3-10(8-15)4-6-11/h3-6,13H,7H2,1-2H3
InChIKey RWXAQBYFXKJTBG-UHFFFAOYSA-N
Mol Weight 259.32 g/mol
Molecular Formula C14H13NO2S
Exact Mass 259.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcOFExBFuRX
Name 6-Methyl-5-methylthio-2-(4-cyanophenyl)-2,3-dihydro-4-pyrone
Alternate Name(s) 4-[6-methyl-5-(methylsulfanyl)-4-oxo-3,4-dihydro-2H-pyran-2-yl]benzonitrile 4-[6-methyl-5-(methylthio)-4-oxo-2,3-dihydropyran-2-yl]benzonitrile 4-(6-Methyl-5-methylsulfanyl-4-oxo-2,3-dihydropyran-2-yl)benzonitrile 4-(6-Methyl-5-methylsulfanyl-4-oxidanylidene-2,3-dihydropyran-2-yl)benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO2S
InChI InChI=1S/C14H13NO2S/c1-9-14(18-2)12(16)7-13(17-9)11-5-3-10(8-15)4-6-11/h3-6,13H,7H2,1-2H3
InChIKey RWXAQBYFXKJTBG-UHFFFAOYSA-N
Molecular Weight 259.323 g/mol
SMILES C1(CC(C(=C(O1)C)SC)=O)c1ccc(cc1)C#N
SPLASH splash10-000f-9220000000-db5a915f0ba020d140b3
Source of Spectrum E1-38-332-4
Wiley ID 1518162