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Valeric acid methyl ester
SpectraBase Compound ID Lo3hagunXkW
InChI InChI=1S/C6H12O2/c1-3-4-5-6(7)8-2/h3-5H2,1-2H3
InChIKey HNBDRPTVWVGKBR-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 BIFCra78gwz
Name Pentanoic acid, methyl ester
CAS Registry Number 624-24-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-3-4-5-6(7)8-2/h3-5H2,1-2H3
InChIKey HNBDRPTVWVGKBR-UHFFFAOYSA-N
Molecular Weight 116.160 g/mol
SMILES CCCCC(=O)OC
SPLASH splash10-05dl-9000000000-c1f1e61dbc381719d019
Source of Spectrum AA-0-429-3
Synonyms Valeric acid, methyl ester CH3(CH2)3COOCH3 Methyl ester of pentanoic acid Methyl n-valerate Methyl pentanoate Methyl valerate Methyl valerianate n-Valeric acid methyl ester Pentanoic acid methyl ester BRN 1741905 EINECS 210-838-0 FEMA NO. 2752
Wiley ID 1125466