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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)

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SpectraBase Spectrum ID 16hW1Ij8ljA
Name 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
Molecular Weight 224.274 g/mol
SMILES CC(C(OC(C)=O)Sc1ccccc1)=O
SPLASH splash10-01ox-9800000000-b5adca3fd66308d6b7ec
Source of Spectrum W5-1989-9472-1
Synonyms (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
Wiley ID 1224674