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4-Phenyl-1-(Phenylsulfinyl)-2-butanone
SpectraBase Compound ID JrNRyVyWSA0
InChI InChI=1S/C16H16O2S/c17-15(12-11-14-7-3-1-4-8-14)13-19(18)16-9-5-2-6-10-16/h1-10H,11-13H2
InChIKey SCPPOGBXPPGDJL-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 6h82On8nr4X
Name 4-Phenyl-1-(Phenylsulfinyl)-2-butanone
Alternate Name(s) 1-(Phenylsulfinyl)-4-phenylbutan-2-one 1-(benzenesulfinyl)-4-phenyl-2-butanone 1-(benzenesulfinyl)-4-phenylbutan-2-one 4-Phenyl-1-(phenylsulfinyl)butan-2-one
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Formula C16H16O2S
InChI InChI=1S/C16H16O2S/c17-15(12-11-14-7-3-1-4-8-14)13-19(18)16-9-5-2-6-10-16/h1-10H,11-13H2
InChIKey SCPPOGBXPPGDJL-UHFFFAOYSA-N
Molecular Weight 272.362 g/mol
SMILES C(C(CCc1ccccc1)=O)S(=O)c1ccccc1
SPLASH splash10-0a4j-0910000000-00a407ad07cbf4d09b8e
Source of Spectrum E2-51-603-3
Wiley ID 1556091