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Pentanoic acid, 3-methyl-, methyl ester
SpectraBase Compound ID 313ml89WFEa
InChI InChI=1S/C7H14O2/c1-4-6(2)5-7(8)9-3/h6H,4-5H2,1-3H3
InChIKey FHASOOYJUZKVFW-UHFFFAOYSA-N
Mol Weight 130.19 g/mol
Molecular Formula C7H14O2
Exact Mass 130.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hi6RjeV0API
Name Pentanoic acid, 3-methyl-, methyl ester
CAS Registry Number 2177-78-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O2
InChI InChI=1S/C7H14O2/c1-4-6(2)5-7(8)9-3/h6H,4-5H2,1-3H3
InChIKey FHASOOYJUZKVFW-UHFFFAOYSA-N
Molecular Weight 130.187 g/mol
SMILES CC(CC)CC(=O)OC
SPLASH splash10-00dl-9000000000-acf15c2792d1060d6a41
Source of Spectrum AA-0-596-4
Synonyms 3-Methylpentanoic acid methyl ester 3-Methylvaleric acid methyl ester Methyl .beta.-methylvalerate Methyl 3-methylpentanoate Valeric acid, 3-methyl-, methyl ester
Wiley ID 5692