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3-(Methylthio)-4-phenyl-2-butanone
SpectraBase Compound ID HumudrF8PVv
InChI InChI=1S/C11H14OS/c1-9(12)11(13-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3
InChIKey GRUBNPRMRBVOMQ-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 61FZHsFFYSs
Name 3-(Methylthio)-4-phenyl-2-butanone
Alternate Name(s) 3-Methylsulfanyl-4-phenylbutan-2-one 3-Methylsulfanyl-4-phenyl-butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-9(12)11(13-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3
InChIKey GRUBNPRMRBVOMQ-UHFFFAOYSA-N
Molecular Weight 194.292 g/mol
SMILES C(C(=O)C)(Cc1ccccc1)SC
SPLASH splash10-0udj-0900000000-8333545fe7893ce885b1
Source of Spectrum F-67-2309-0
Wiley ID 1686031