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Hexanoic acid isopentyl ester
SpectraBase Compound ID BAN3isZzBIg
InChI InChI=1S/C11H22O2/c1-4-5-6-7-11(12)13-9-8-10(2)3/h10H,4-9H2,1-3H3
InChIKey XVSZRAWFCDHCBP-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5zC7K5WeFk
Name Isopentyl hexanoate
Comments MONAID: JP006991
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-4-5-6-7-11(12)13-9-8-10(2)3/h10H,4-9H2,1-3H3
InChIKey XVSZRAWFCDHCBP-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 186.295 g/mol
SMILES CCCCCC(=O)OCCC(C)C
SPLASH splash10-00dl-9000000000-ce193357386508bde105
Source of Spectrum SRH-2022-6991-0
Wiley ID 1828792