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

*Links on SpectraBase are not permalinks.
2-Oxo-1-(phenylsulfanyl)butyl acetate
SpectraBase Compound ID 2NjKaBWNNpy
InChI InChI=1S/C12H14O3S/c1-3-11(14)12(15-9(2)13)16-10-7-5-4-6-8-10/h4-8,12H,3H2,1-2H3
InChIKey RFVWYFNEPGNFSF-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 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 G1B4t52rCnV
Name 2-Oxo-1-(phenylsulfanyl)butyl acetate
CAS Registry Number 67175-44-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-3-11(14)12(15-9(2)13)16-10-7-5-4-6-8-10/h4-8,12H,3H2,1-2H3
InChIKey RFVWYFNEPGNFSF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000376
Molecular Weight 238.301 g/mol
SMILES C(C)(=O)OC(C(CC)=O)Sc1ccccc1
SPLASH splash10-01q0-0900000000-173b3ae42cae9502b691
Source of Spectrum ASC-352-2955/SM2-1c
Synonyms (2-oxidanylidene-1-phenylsulfanyl-butyl) ethanoate 2-Oxo-1-(phenylthio)butyl acetate 1-Phenylthio-1-acetoxy-2-butanone Acetic acid [2-oxo-1-(phenylthio)butyl] ester (2-oxo-1-phenylsulfanylbutyl) acetate (2-oxo-1-phenylsulfanyl-butyl) acetate
Wiley ID 1764071