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Butyrylthioacetic acid, ethyl ester
SpectraBase Compound ID L92Ubnut6ws
InChI InChI=1S/C8H14O3S/c1-3-5-8(10)12-6-7(9)11-4-2/h3-6H2,1-2H3
InChIKey WAQFGMFENWQFBB-UHFFFAOYSA-N
Mol Weight 190.26 g/mol
Molecular Formula C8H14O3S
Exact Mass 190.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LQt2gFYsZZ
Name Butyrylthioacetic acid, ethyl ester
Alternate Name(s) 2-(1-oxobutylthio)acetic acid ethyl ester 2-(butyrylthio)acetic acid ethyl ester Ethyl (butyrylsulfanyl)acetate Ethyl 2-butanoylsulfanylacetate Ethyl 2-butanoylsulfanylethanoate
CAS Registry Number 32357-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3S
InChI InChI=1S/C8H14O3S/c1-3-5-8(10)12-6-7(9)11-4-2/h3-6H2,1-2H3
InChIKey WAQFGMFENWQFBB-UHFFFAOYSA-N
Molecular Weight 190.257 g/mol
SMILES C(=O)(CSC(CCC)=O)OCC
SPLASH splash10-00dl-9000000000-49dfbce96e1141749ab4
Wiley ID 1484381