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Methyl hexanoate
SpectraBase Compound ID BNGYVwPw12C
InChI InChI=1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3
InChIKey NUKZAGXMHTUAFE-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 GxJQyWKzmpj
Name Hexanoic acid methyl ester
Alternate Name(s) Caproic acid, methyl ester Methyl caproate Methyl capronate Methyl ester of hexanoic acid Methyl hexanoate Methyl hexoate Methyl hexylate Methyl n-hexanoate n-Caproic acid methyl ester BRN 1744683 EINECS 203-425-1 FEMA NO. 2708 NSC 5023
CAS Registry Number 106-70-7
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Formula C7H14O2
InChI InChI=1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3
InChIKey NUKZAGXMHTUAFE-UHFFFAOYSA-N
Molecular Weight 130.187 g/mol
SMILES CCCCCC(=O)OC
SPLASH splash10-0096-9000000000-d5fb3d38905f144c6184
Source of Spectrum AA-0-595-3
Wiley ID 70720