| SpectraBase Spectrum ID |
Jfg1adVTpLU |
| Name |
Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, isopropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.126322711 u |
| Formula |
C15H19NO5 |
| InChI |
InChI=1S/C15H19NO5/c1-10(2)21-15(18)8-7-14(17)16-12-6-5-11(19-3)9-13(12)20-4/h5-10H,1-4H3,(H,16,17)/b8-7+ |
| InChIKey |
KFNWBZQRZYKFHT-BQYQJAHWSA-N |
| SMILES |
COC1=CC=C(C(OC)=C1)NC(\C=C\C(=O)OC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940577 |
