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1-[(Phenylthio)carbonyl]propyl acetate
SpectraBase Compound ID CM3ftXFv8LQ
InChI InChI=1S/C12H14O3S/c1-3-11(15-9(2)13)12(14)16-10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey AWFGCFSEPZAPQL-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 F0zKnnbe5c9
Name 1-[(Phenylthio)carbonyl]propyl acetate
Alternate Name(s) 1-Oxo-1-(phenylthio)butan-2-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-3-11(15-9(2)13)12(14)16-10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey AWFGCFSEPZAPQL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000376
Molecular Weight 238.301 g/mol
SMILES C(C)(=O)OC(CC)C(=O)Sc1ccccc1
SPLASH splash10-0imi-0900000000-6244a337bbf64dbed7be
Source of Spectrum ASC-352-2959-2c
Wiley ID 1764060