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1-(Methylthio)-4-phenyl-2-butanone
SpectraBase Compound ID 1jgVAU0rhgt
InChI InChI=1S/C11H14OS/c1-13-9-11(12)8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey QBMAKZMFYWMIOW-UHFFFAOYSA-N
Mol Weight 194.29 g/mol
Molecular Formula C11H14OS
Exact Mass 194.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTXN07DmZli
Name 1-(Methylthio)-4-phenyl-2-butanone
Alternate Name(s) 1-methylsulfanyl-4-phenylbutan-2-one 1-methylsulfanyl-4-phenyl-butan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-13-9-11(12)8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey QBMAKZMFYWMIOW-UHFFFAOYSA-N
Molecular Weight 194.292 g/mol
SMILES C(=O)(CCc1ccccc1)CSC
SPLASH splash10-0a4l-0900000000-9acb3c44723ddbdac2f4
Source of Spectrum F-67-2309-0
Wiley ID 1686030