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3-(Methylthio)-1-phenyl-2-butanone
SpectraBase Compound ID 8p17e2Jlayl
InChI InChI=1S/C11H14OS/c1-9(13-2)11(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey CDZADZHIWVWNRB-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 3O9Xg2bsp8w
Name 3-(Methylthio)-1-phenyl-2-butanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-9(13-2)11(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey CDZADZHIWVWNRB-UHFFFAOYSA-N
Molecular Weight 194.292 g/mol
SMILES C(Cc1ccccc1)(=O)C(SC)C
SPLASH splash10-0007-0900000000-c34bae9077da448ffc8c
Source of Spectrum F-67-2311-13
Wiley ID 1686020