| SpectraBase Spectrum ID |
CCS88EflRDR |
| Name |
2-(N-Phenylbenzamido)-m-toluic acid, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
345.136493473 u |
| Formula |
C22H19NO3 |
| InChI |
InChI=1S/C22H19NO3/c1-16-10-9-15-19(22(25)26-2)20(16)23(18-13-7-4-8-14-18)21(24)17-11-5-3-6-12-17/h3-15H,1-2H3 |
| InChIKey |
MDCUKWPYAGVIKN-UHFFFAOYSA-N |
| Molecular Weight |
345.398 g/mol |
| SMILES |
C1=C(C(=C(C=C1)C)N(C(C=1C=CC=CC1)=O)C=1C=CC=CC1)C(=O)OC |
| Spectrum/Structure Validation Score (Raman) |
0.932289 |
