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Ethanethioic acid, S-(2-methylpropyl) ester
SpectraBase Compound ID BA7ayiewzRE
InChI InChI=1S/C6H12OS/c1-5(2)4-8-6(3)7/h5H,4H2,1-3H3
InChIKey CKZPJEYIMQJCNA-UHFFFAOYSA-N
Mol Weight 132.22 g/mol
Molecular Formula C6H12OS
Exact Mass 132.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KwUK9QY8fxI
Name Ethanethioic acid, S-(2-methylpropyl) ester
CAS Registry Number 2432-37-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12OS
InChI InChI=1S/C6H12OS/c1-5(2)4-8-6(3)7/h5H,4H2,1-3H3
InChIKey CKZPJEYIMQJCNA-UHFFFAOYSA-N
Molecular Weight 132.221 g/mol
SMILES C(SC(C)=O)C(C)C
SPLASH splash10-0006-9000000000-2662a61bdbc8e2a61d33
Source of Spectrum EP-1928-0-0
Synonyms S-Isobutyl ethanethioate Acetic acid, thio-, S-isobutyl ester CH3C(O)SCH2CH(CH3)2 Ethanethioic acid S-isobutyl ester S-(2-methylpropyl) ethanethioate S-Isobutyl thioacetate
Wiley ID 1133661