| SpectraBase Spectrum ID |
9cEdT5FDXIo |
| Name |
5-[p-Methoxyphenyl]-2,4-pentadienoic acid ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.109944372 u |
| Formula |
C14H16O3 |
| InChI |
InChI=1S/C14H16O3/c1-3-17-14(15)7-5-4-6-12-8-10-13(16-2)11-9-12/h4-11H,3H2,1-2H3/b6-4+,7-5+ |
| InChIKey |
XPJLOINLVSTSQQ-YDFGWWAZSA-N |
| Molecular Weight |
232.279 g/mol |
| SMILES |
C(\C=C\C=C\C1=CC=C(C=C1)OC)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958264 |
![5-[p-Methoxyphenyl]-2,4-pentadienoic acid ethyl ester](/api/spectrum/9cEdT5FDXIo/structure.png?h=300&w=458 "5-[p-Methoxyphenyl]-2,4-pentadienoic acid ethyl ester")
