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1-Methyl-2-oxo-1-(phenylsulfanyl)propyl acetate
SpectraBase Compound ID KeAENsLTddN
InChI InChI=1S/C12H14O3S/c1-9(13)12(3,15-10(2)14)16-11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey FPUYOWCGHZTDRS-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Dp1NrbtyKb
Name 1-Methyl-2-oxo-1-(phenylsulfanyl)propyl acetate
CAS Registry Number 29943-31-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-9(13)12(3,15-10(2)14)16-11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey FPUYOWCGHZTDRS-UHFFFAOYSA-N
Molecular Weight 238.301 g/mol
SMILES CC(C(C)(OC(C)=O)Sc1ccccc1)=O
SPLASH splash10-0006-9600000000-1b63a964993990109856
Source of Spectrum W5-1989-9479-1
Synonyms (3-oxidanylidene-2-phenylsulfanyl-butan-2-yl) ethanoate (3-oxo-2-phenylsulfanylbutan-2-yl) acetate 1-Phenylthio-1-acetoxy-1-methyl-2-propanone Acetic acid [3-oxo-2-(phenylthio)butan-2-yl] ester (1-methyl-2-oxo-1-phenylsulfanyl-propyl) acetate
Wiley ID 1240228