| SpectraBase Spectrum ID |
2sPnpPdlr04 |
| Name |
Trans-m-(3,4,5-trimethoxycinnamamido)benzoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
357.121237330 u |
| Formula |
C19H19NO6 |
| InChI |
InChI=1S/C19H19NO6/c1-24-15-9-12(10-16(25-2)18(15)26-3)7-8-17(21)20-14-6-4-5-13(11-14)19(22)23/h4-11H,1-3H3,(H,20,21)(H,22,23)/b8-7+ |
| InChIKey |
FATHVQCGAOBTKJ-BQYQJAHWSA-N |
| Molecular Weight |
357.362 g/mol |
| SMILES |
N(C(\C=C\C1=CC(=C(C(=C1)OC)OC)OC)=O)C=1C=C(C(O)=O)C=CC1 |
| Spectrum/Structure Validation Score (Raman) |
0.757001 |
