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3-Pentanone, 2-(phenylthio)-
SpectraBase Compound ID 9NkCOKT2XoL
InChI InChI=1S/C11H14OS/c1-3-11(12)9(2)13-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey FYHMROZMCQYUKO-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 Ajp60wxOaIs
Name 3-Pentanone, 2-(phenylthio)-
Alternate Name(s) 2-(Phenylthio)-3-pentanone 2-Phenylsulfanylpentan-3-one
CAS Registry Number 27872-70-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-3-11(12)9(2)13-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey FYHMROZMCQYUKO-UHFFFAOYSA-N
Molecular Weight 194.292 g/mol
SMILES C(Sc1ccccc1)(C(=O)CC)C
SPLASH splash10-000l-0900000000-dce10b86dabfa7bca0db
Source of Spectrum KC-1979-1086-0
Wiley ID 1190552