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4-(phenylthio)-2-butanone

View entire compound with spectra: 3 NMR, 1 FTIR, and 3 MS (GC)

4-(phenylthio)-2-butanone
SpectraBase Compound ID L5NS1YOsVob
InChI InChI=1S/C10H12OS/c1-9(11)7-8-12-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
InChIKey AMQQWFLSHDKPPI-UHFFFAOYSA-N
Mol Weight 180.26 g/mol
Molecular Formula C10H12OS
Exact Mass 180.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 579o8WXv0qD
Name 2-Butanone, 4-(phenylthio)-
CAS Registry Number 6110-01-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12OS
InChI InChI=1S/C10H12OS/c1-9(11)7-8-12-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
InChIKey AMQQWFLSHDKPPI-UHFFFAOYSA-N
Molecular Weight 180.265 g/mol
SMILES C(=O)(CCSc1ccccc1)C
SPLASH splash10-01q9-0900000000-81b48276ed8bdd57a278
Source of Spectrum J-60-2024-1
Synonyms 4-(Phenylthio)-2-butanone 4-(Phenylthio)butan-2-one 4-Phenylsulfanylbutan-2-one
Wiley ID 1176045