For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Oxo-1-(phenylsulfanyl)propyl acetate
SpectraBase Compound ID KHZrGIS4oJN
InChI InChI=1S/C11H12O3S/c1-8(12)11(14-9(2)13)15-10-6-4-3-5-7-10/h3-7,11H,1-2H3
InChIKey XKSAUVXGTIGHRO-UHFFFAOYSA-N
Mol Weight 224.27 g/mol
Molecular Formula C11H12O3S
Exact Mass 224.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7RFfCYW76J2
Name 2-Oxo-1-(phenylsulfanyl)propyl acetate
Alternate Name(s) (2-oxidanylidene-1-phenylsulfanyl-propyl) ethanoate 2-Oxo-1-(phenylthio)propyl acetate 1-Phenylthio-1-acetoxy-2-propanone Acetic acid [2-oxo-1-(phenylthio)propyl] ester (2-oxo-1-phenylsulfanylpropyl) acetate (2-oxo-1-phenylsulfanyl-propyl) acetate
CAS Registry Number 22198-56-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3S
InChI InChI=1S/C11H12O3S/c1-8(12)11(14-9(2)13)15-10-6-4-3-5-7-10/h3-7,11H,1-2H3
InChIKey XKSAUVXGTIGHRO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000376
Molecular Weight 224.274 g/mol
SMILES C(C)(=O)OC(C(C)=O)Sc1ccccc1
SPLASH splash10-01qi-0910000000-ab497e869a520ceb8928
Source of Spectrum ASC-352-2955/SM2-1a
Wiley ID 1764069