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Ethylbutyrate
SpectraBase Compound ID 5uZfIAc292u
InChI InChI=1S/C6H12O2/c1-3-5-6(7)8-4-2/h3-5H2,1-2H3
InChIKey OBNCKNCVKJNDBV-UHFFFAOYSA-N
Mol Weight 116.16 g/mol
Molecular Formula C6H12O2
Exact Mass 116.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7qmispcMYcT
Name Butyrate
CAS Registry Number 105-54-4
Classification Fatty esters; Fatty acid ethyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-3-5-6(7)8-4-2/h3-5H2,1-2H3
InChIKey OBNCKNCVKJNDBV-UHFFFAOYSA-N
Number of Peaks 56
RI2 436
RI4 831
RI5 522
SMILES C(CCC)(=O)OCC
SPLASH splash10-00dr-9000000000-85d555a4c7b8a7635738
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Butanoic acid, ethyl ester Et. C4:0
Wiley ID LM_LIPIDS2016_96