| SpectraBase Spectrum ID |
3l2yWfur3OL |
| Name |
Methyl 2-(2-methoxy-5-methylphenyl)pent-4-enoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.125594437 u |
| Formula |
C14H18O3 |
| InChI |
InChI=1S/C14H18O3/c1-5-6-11(14(15)17-4)12-9-10(2)7-8-13(12)16-3/h5,7-9,11H,1,6H2,2-4H3 |
| InChIKey |
MFIONFBIHKMJSG-UHFFFAOYSA-N |
| Molecular Weight |
234.295 g/mol |
| SMILES |
C(C(CC=C)C=1C(=CC=C(C1)C)OC)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.809963 |
