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

*Links on SpectraBase are not permalinks.
Benzenepropanoic acid, .alpha.-(2-methyl-1-propenyl)-.beta.-oxo-, methyl ester
SpectraBase Compound ID COYv2tbB2X7
InChI InChI=1S/C14H16O3/c1-10(2)9-12(14(16)17-3)13(15)11-7-5-4-6-8-11/h4-9,12H,1-3H3
InChIKey WIDSBYQSZRMONG-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 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 7b2oTdu9EAg
Name Benzenepropanoic acid, .alpha.-(2-methyl-1-propenyl)-.beta.-oxo-, methyl ester
Alternate Name(s) Methyl 2-benzoyl-4-methyl-3-pentenoate Methyl-2-(4-methoxybenzoyl)-4-methyl-pent-3-enoate Methyl-2-benzoyl-4-methyl-pent-3-enoate
CAS Registry Number 86577-12-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-10(2)9-12(14(16)17-3)13(15)11-7-5-4-6-8-11/h4-9,12H,1-3H3
InChIKey WIDSBYQSZRMONG-UHFFFAOYSA-N
Molecular Weight 232.279 g/mol
SMILES C(C(=O)c1ccccc1)(C=C(C)C)C(=O)OC
SPLASH splash10-0a4i-9700000000-e1ed67f47b46c564056d
Source of Spectrum F-46-1277-14
Wiley ID 1233956