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

*Links on SpectraBase are not permalinks.

Methyl 5-Oxo-3-allyloctanoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Methyl 5-Oxo-3-allyloctanoate
SpectraBase Compound ID BzH50L664CV
InChI InChI=1S/C12H20O3/c1-4-6-10(9-12(14)15-3)8-11(13)7-5-2/h4,10H,1,5-9H2,2-3H3
InChIKey CROJBGUWUYETKZ-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 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 2rjxVopHgus
Name Methyl 5-Oxo-3-allyloctanoate
Alternate Name(s) 5-Oxo-3-prop-2-enyloctanoic acid methyl ester Methyl 5-oxo-3-prop-2-enyloctanoate Methyl 3-allyl-5-oxo-octanoate Methyl 5-oxidanylidene-3-prop-2-enyl-octanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-4-6-10(9-12(14)15-3)8-11(13)7-5-2/h4,10H,1,5-9H2,2-3H3
InChIKey CROJBGUWUYETKZ-UHFFFAOYSA-N
Molecular Weight 212.289 g/mol
SMILES C(CC(CC(CCC)=O)CC=C)(=O)OC
SPLASH splash10-01xx-9000000000-b6aeedc3227f72cd6a26
Source of Spectrum U1-2012-5824-8b
Wiley ID 1715691