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

*Links on SpectraBase are not permalinks.
(E)-3-(1-cyclohepta-2,4,6-trienyl)-2-propenoic acid methyl ester
SpectraBase Compound ID 64sk8rLeA97
InChI InChI=1S/C11H12O2/c1-13-11(12)9-8-10-6-4-2-3-5-7-10/h2-10H,1H3/b9-8+
InChIKey MSIHEDNJVJGAGI-CMDGGOBGSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 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 FlkL2MVT3hi
Name (E)-3-(1-cyclohepta-2,4,6-trienyl)-2-propenoic acid methyl ester
Alternate Name(s) Propenoic acid, 3-(cycloheptatrien-7-yl)-, methyl ester (E)-3-cyclohepta-2,4,6-trien-1-ylacrylic acid methyl ester Methyl (2E)-3-(2,4,6-cycloheptatrien-1-yl)-2-propenoate Methyl (E)-3-cyclohepta-2,4,6-trien-1-ylprop-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-13-11(12)9-8-10-6-4-2-3-5-7-10/h2-10H,1H3/b9-8+
InChIKey MSIHEDNJVJGAGI-CMDGGOBGSA-N
Molecular Weight 176.215 g/mol
SMILES C1=CC=CC(C=C1)\C=C\C(OC)=O
SPLASH splash10-014i-3900000000-6ac8816261ee4e3e4196
Source of Spectrum AD-0-2532-0
Wiley ID 1430689