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Pentanamide, 4-methyl-3-oxo-4-(phenylthio)-
SpectraBase Compound ID F6O289UFywd
InChI InChI=1S/C12H15NO2S/c1-12(2,10(14)8-11(13)15)16-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,13,15)
InChIKey JVHBCQFKUWUHPE-UHFFFAOYSA-N
Mol Weight 237.32 g/mol
Molecular Formula C12H15NO2S
Exact Mass 237.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6b8jqAuFvpO
Name Pentanamide, 4-methyl-3-oxo-4-(phenylthio)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO2S
InChI InChI=1S/C12H15NO2S/c1-12(2,10(14)8-11(13)15)16-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,13,15)
InChIKey JVHBCQFKUWUHPE-UHFFFAOYSA-N
Molecular Weight 237.317 g/mol
SMILES NC(CC(C(C)(C)Sc1ccccc1)=O)=O
SPLASH splash10-0gvo-9600000000-93d01e2e87e9e72dc579
Source of Spectrum JX-2015-1-142
Synonyms 4-Methyl-3-oxo-4-(phenylthio)pentanamide 4-Methyl-3-oxo-4-(phenylsulfanyl)pentanamide 4-Methyl-3-oxo-4-phenylsulfanylpentanamide 4-Methyl-3-oxo-4-phenylsulfanyl-pentanamide 4-Methyl-3-oxidanylidene-4-phenylsulfanyl-pentanamide
Wiley ID 1720999