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1-Phenyl-3-phenylsulfinyl-2-butanone
SpectraBase Compound ID 9PHcoQtGKrh
InChI InChI=1S/C16H16O2S/c1-13(19(18)15-10-6-3-7-11-15)16(17)12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3
InChIKey QEDRLIPDMYMQDT-UHFFFAOYSA-N
Mol Weight 272.36 g/mol
Molecular Formula C16H16O2S
Exact Mass 272.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1aJw8TKYmw
Name 1-Phenyl-3-phenylsulfinyl-2-butanone
CAS Registry Number 105824-06-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2S
InChI InChI=1S/C16H16O2S/c1-13(19(18)15-10-6-3-7-11-15)16(17)12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3
InChIKey QEDRLIPDMYMQDT-UHFFFAOYSA-N
Molecular Weight 272.362 g/mol
SMILES C(S(=O)c1ccccc1)(C(Cc1ccccc1)=O)C
SPLASH splash10-0007-8900000000-0cdfee82b4cb35fba897
Source of Spectrum AJ-59-947-3
Wiley ID 1276228