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

*Links on SpectraBase are not permalinks.

(2Z,4E)-3-Methoxymethyl-5-phenylpent-2,4-dienoic acid

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

(2Z,4E)-3-Methoxymethyl-5-phenylpent-2,4-dienoic acid
SpectraBase Compound ID KIkzk9h1BXH
InChI InChI=1S/C13H14O3/c1-16-10-12(9-13(14)15)8-7-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,14,15)/b8-7+,12-9-
InChIKey KGKMPQNMSBEMLZ-GHYOLMRSSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID AiLgq9pHuG1
Name (2Z,4E)-3-Methoxymethyl-5-phenylpent-2,4-dienoic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.094294308 u
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-16-10-12(9-13(14)15)8-7-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,14,15)/b8-7+,12-9-
InChIKey KGKMPQNMSBEMLZ-GHYOLMRSSA-N
Molecular Weight 218.252 g/mol
SMILES C(\C=C\(\C=C\C=1C=CC=CC1)COC)(=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.978055