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2-Butanone, 1-phenyl-1-(phenylthio)-
SpectraBase Compound ID 22qFTb3mhH3
InChI InChI=1S/C16H16OS/c1-2-15(17)16(13-9-5-3-6-10-13)18-14-11-7-4-8-12-14/h3-12,16H,2H2,1H3
InChIKey SWXIVXLWKRRQSO-UHFFFAOYSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G44pzqiFDPp
Name 2-Butanone, 1-phenyl-1-(phenylthio)-
Alternate Name(s) 1-Phenyl-1-(phenylsulfanyl)-2-butanone 1-Phenyl-1-phenylthio-2-butanone
CAS Registry Number 95110-54-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c1-2-15(17)16(13-9-5-3-6-10-13)18-14-11-7-4-8-12-14/h3-12,16H,2H2,1H3
InChIKey SWXIVXLWKRRQSO-UHFFFAOYSA-N
Molecular Weight 256.363 g/mol
SMILES C(Sc1ccccc1)(C(=O)CC)c1ccccc1
SPLASH splash10-0002-1910000000-7c8ff74d9c1811b8f775
Source of Spectrum AJ-58-2853-5
Wiley ID 1260011