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1-[4-(Methylthio)phenyl]butan-2-one
SpectraBase Compound ID FxKbINRNBTt
InChI InChI=1S/C11H14OS/c1-3-10(12)8-9-4-6-11(13-2)7-5-9/h4-7H,3,8H2,1-2H3
InChIKey ZGWJWTIJZNHZKE-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 DyOFhFWPizy
Name 1-[4-(Methylthio)phenyl]butan-2-one
Alternate Name(s) 1-(4-(methylthio)phenyl)butan-2-one 1-[4-(methylthio)phenyl]-2-butanone 1-(4-Methylsulfanylphenyl)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-3-10(12)8-9-4-6-11(13-2)7-5-9/h4-7H,3,8H2,1-2H3
InChIKey ZGWJWTIJZNHZKE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.200800161
Molecular Weight 194.292 g/mol
SMILES c1c(ccc(CC(CC)=O)c1)SC
SPLASH splash10-000i-0900000000-c138a41080756e592e76
Source of Spectrum CAJ-3-1686-4o
Wiley ID 1775082