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Isobutyric acid ethyl ester
SpectraBase Compound ID Drj09VlmRkj
InChI InChI=1S/C6H12O2/c1-4-8-6(7)5(2)3/h5H,4H2,1-3H3
InChIKey WDAXFOBOLVPGLV-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 BBoMe5sPZXm
Name Isobutyric acid, ethyl ester
CAS Registry Number 97-62-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-4-8-6(7)5(2)3/h5H,4H2,1-3H3
InChIKey WDAXFOBOLVPGLV-UHFFFAOYSA-N
Molecular Weight 116.160 g/mol
SMILES CCOC(=O)C(C)C
SPLASH splash10-0006-9000000000-f380ed5e0d249b9da6e5
Source of Spectrum MG-537-0-0
Synonyms Propanoic acid, 2-methyl-, ethyl ester 2-Methylpropanoic acid ethyl ester 2-Methylpropionic acid ethyl ester Ethyl 2,2-dimethylacetate Ethyl 2-methylpropanoate Ethyl 2-methylpropionate Ethyl ester of 2-methyl-propanoic acid Ethyl iso-butyrate Ethyl isobutanoate Propionic acid, 2-methyl-, ethyl ester AI3-06121 BRN 0773846 EINECS 202-595-4 FEMA NO. 2428 NSC 97194 UN2385
Wiley ID 1125514