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Perillyl isobutyrate
SpectraBase Compound ID ILeMG926ytm
InChI InChI=1S/C14H22O2/c1-10(2)13-7-5-12(6-8-13)9-16-14(15)11(3)4/h5,11,13H,1,6-9H2,2-4H3
InChIKey KAQYLYYVKDTFRT-UHFFFAOYSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhMXqh3ZCjb
Name Perillyl isobutyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-10(2)13-7-5-12(6-8-13)9-16-14(15)11(3)4/h5,11,13H,1,6-9H2,2-4H3
InChIKey KAQYLYYVKDTFRT-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 222.328 g/mol
SMILES CC(C)C(=O)OCC=1CCC(CC1)C(C)=C
SPLASH splash10-0006-9300000000-3c148df261e0d6033100
Source of Spectrum SRH-2022-6979-0
Synonyms 4-(1-Methylethenyl)-1-cyclohexenylmethyl isobutyrate
Wiley ID 1828780