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1-(Phenylsulfanyl)acetone
SpectraBase Compound ID 8qbjZ8dMAqg
InChI InChI=1S/C9H10OS/c1-8(10)7-11-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey XREBEJBUPRGGTB-UHFFFAOYSA-N
Mol Weight 166.24 g/mol
Molecular Formula C9H10OS
Exact Mass 166.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILJw8DtFn2h
Name 1-(Phenylsulfanyl)acetone
CAS Registry Number 5042-53-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10OS
InChI InChI=1S/C9H10OS/c1-8(10)7-11-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey XREBEJBUPRGGTB-UHFFFAOYSA-N
Molecular Weight 166.238 g/mol
SMILES C(Sc1ccccc1)C(=O)C
SPLASH splash10-0a4i-9300000000-0e6424aac4293ee96647
Source of Spectrum F9-1988-1597-0
Synonyms 1-(Phenylthio)-2-propanone 1-(Phenylthio)acetone 1-Phenylsulfanylpropan-2-one
Wiley ID 1565911