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Hexyl pentanoate

View entire compound with spectra: 8 MS (GC)

Hexyl pentanoate
SpectraBase Compound ID 7uZOJRGW76a
InChI InChI=1S/C11H22O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h3-10H2,1-2H3
InChIKey YERFHJZYNMRVLO-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 C1MtZhEfnXn
Name Hexyl pentanoate
CAS Registry Number 1117-59-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h3-10H2,1-2H3
InChIKey YERFHJZYNMRVLO-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
SMILES CCCCCCOC(=O)CCCC
SPLASH splash10-0a4u-9100000000-faabc72c8dc0d97131d4
Source of Spectrum JZ-1992-3734-0
Synonyms 1-Hexyl n-valerate Hexyl n-valerate Hexyl valerate Hexyl valerianate Pentanoic acid hexyl ester valeric acid hexyl ester AI3-30516 EINECS 214-248-4 NSC 21861
Wiley ID 1183108