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2-Oxo-3-phenyl-1-(phenylsulfanyl)propyl acetate
SpectraBase Compound ID 2UxB2oieoi2
InChI InChI=1S/C17H16O3S/c1-13(18)20-17(21-15-10-6-3-7-11-15)16(19)12-14-8-4-2-5-9-14/h2-11,17H,12H2,1H3
InChIKey QMYNORWZXYNZML-UHFFFAOYSA-N
Mol Weight 300.37 g/mol
Molecular Formula C17H16O3S
Exact Mass 300.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xl4z9fWgxg
Name 2-Oxo-3-phenyl-1-(phenylsulfanyl)propyl acetate
Alternate Name(s) (2-oxidanylidene-3-phenyl-1-phenylsulfanyl-propyl) ethanoate 1-Phenylthio-1-acetoxy-3-phenyl-2-propanone Acetic acid [2-oxo-3-phenyl-1-(phenylthio)propyl] ester (2-oxo-3-phenyl-1-phenylsulfanylpropyl) acetate (2-oxo-3-phenyl-1-phenylsulfanyl-propyl) acetate
CAS Registry Number 69798-72-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O3S
InChI InChI=1S/C17H16O3S/c1-13(18)20-17(21-15-10-6-3-7-11-15)16(19)12-14-8-4-2-5-9-14/h2-11,17H,12H2,1H3
InChIKey QMYNORWZXYNZML-UHFFFAOYSA-N
Molecular Weight 300.372 g/mol
SMILES CC(=O)OC(C(Cc1ccccc1)=O)Sc1ccccc1
SPLASH splash10-0006-9610000000-e7bf622cad8a351624db
Source of Spectrum W5-1989-9470-1
Wiley ID 1302866