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3,3-Dimethyl-4-(phenylthio)-2-butanone
SpectraBase Compound ID 9cFaECBJrc3
InChI InChI=1S/C12H16OS/c1-10(13)12(2,3)9-14-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey BHARQTWELUJTMJ-UHFFFAOYSA-N
Mol Weight 208.32 g/mol
Molecular Formula C12H16OS
Exact Mass 208.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJA9qCVVB2s
Name 3,3-Dimethyl-4-(phenylthio)-2-butanone
Alternate Name(s) 3,3-Dimethyl-4-phenylsulfanyl-butan-2-one 3,3-Dimethyl-4-phenylsulfanylbutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16OS
InChI InChI=1S/C12H16OS/c1-10(13)12(2,3)9-14-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey BHARQTWELUJTMJ-UHFFFAOYSA-N
Molecular Weight 208.319 g/mol
SMILES CC(C(CSc1ccccc1)(C)C)=O
SPLASH splash10-00di-0920000000-61dc65d081b5c6dca7f4
Source of Spectrum KC-0-2868-12
Wiley ID 826422