| SpectraBase Spectrum ID |
1iKSSBdsmbd |
| Name |
Benzoic acid, 2-(benzoylamino)-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
269.105193344 u |
| Formula |
C16H15NO3 |
| InChI |
InChI=1S/C16H15NO3/c1-2-20-16(19)13-10-6-7-11-14(13)17-15(18)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,17,18) |
| InChIKey |
QFRRFICTWYOUEI-UHFFFAOYSA-N |
| Molecular Weight |
269.300 g/mol |
| SMILES |
C1=C(NC(=O)C2=CC=CC=C2)C(=CC=C1)C(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95501 |
