| SpectraBase Spectrum ID |
ChVNik31nsC |
| Name |
Ethyl 2-methyl-5-(p-methoxyphenyl)propenoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.109944372 u |
| Formula |
C13H16O3 |
| InChI |
InChI=1S/C13H16O3/c1-4-16-13(14)10(2)9-11-5-7-12(15-3)8-6-11/h5-9H,4H2,1-3H3/b10-9+ |
| InChIKey |
CATWJJBYIYENLW-MDZDMXLPSA-N |
| Molecular Weight |
220.268 g/mol |
| SMILES |
C(\C(=C\C=1C=CC(=CC1)OC)C)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968228 |
