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Methyl octanoate
SpectraBase Compound ID 7E2G5g3nIeB
InChI InChI=1S/C9H18O2/c1-3-4-5-6-7-8-9(10)11-2/h3-8H2,1-2H3
InChIKey JGHZJRVDZXSNKQ-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Rc3Nvr2eph
Name Octanoic acid methyl ester
Comments CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001020
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-3-4-5-6-7-8-9(10)11-2/h3-8H2,1-2H3
InChIKey JGHZJRVDZXSNKQ-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES CCCCCCCC(=O)OC
SPLASH splash10-000i-9400000000-2e817575fcea00ed4690
Source of Spectrum FM-2019-1020-0
Synonyms Methyl caprylate Methyl octanoate Methyl octylate Methyl n-octanoate Uniphat A20 Caprylic acid methyl ester Methyl octanoate
Wiley ID 1818679