For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-Methoxy-cuminyl isobutyrate
SpectraBase Compound ID BV2EyrhaX8c
InChI InChI=1S/C15H22O3/c1-10(2)13-7-6-12(8-14(13)17-5)9-18-15(16)11(3)4/h6-8,10-11H,9H2,1-5H3
InChIKey JVOZDVTWETUPPI-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3Ckyq8y5epE
Name 3-Methoxy-cuminyl isobutyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-10(2)13-7-6-12(8-14(13)17-5)9-18-15(16)11(3)4/h6-8,10-11H,9H2,1-5H3
InChIKey JVOZDVTWETUPPI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ffj.1824
Molecular Weight 250.338 g/mol
SMILES COc1c(ccc(c1)COC(C(C)C)=O)C(C)C
SPLASH splash10-001c-5890000000-70bde7d253c7c6052398
Source of Spectrum FF-22-485-118
Synonyms 4-Isopropyl-3-methoxybenzyl isobutyrate 2-Methylpropanoic acid (3-methoxy-4-propan-2-ylphenyl)methyl ester (3-methoxy-4-propan-2-ylphenyl)methyl 2-methylpropanoate (4-isopropyl-3-methoxy-phenyl)methyl 2-methylpropanoate (3-methoxy-4-propan-2-yl-phenyl)methyl 2-methylpropanoate
Wiley ID 1775485