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Isobutyric acid butyl ester
SpectraBase Compound ID C5OqMxLSgpJ
InChI InChI=1S/C8H16O2/c1-4-5-6-10-8(9)7(2)3/h7H,4-6H2,1-3H3
InChIKey JSLCOZYBKYHZNL-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID u78OPmpnP2
Name Butylisobutyrate
Alternate Name(s) Isobutyric acid, butyl ester Propanoic acid, 2-methyl-, butyl ester Butyl 2-methylpropanoate 2-Methylpropionic acid butyl ester Butyl ester of 2-methylpropanoic acid Butyl isobutanoate Butyl isobutyrate Isobutyric acid n-butyl ester n-Butyl iso-butyrate AI3-24261 EINECS 202-614-6 FEMA NO. 2188
CAS Registry Number 97-87-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-4-5-6-10-8(9)7(2)3/h7H,4-6H2,1-3H3
InChIKey JSLCOZYBKYHZNL-UHFFFAOYSA-N
Molecular Weight 144.214 g/mol
SMILES CC(C(=O)OCCCC)C
SPLASH splash10-059f-9000000000-9643eadef3bbdd3c9b78
Source of Spectrum IC-205-0-0
Wiley ID 1142698