| SpectraBase Spectrum ID |
FYRfoLf6z8 |
| Name |
2-Amino-benzoic acid 4-chloro-phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.040006264 u |
| Formula |
C13H10ClNO2 |
| InChI |
InChI=1S/C13H10ClNO2/c14-9-5-7-10(8-6-9)17-13(16)11-3-1-2-4-12(11)15/h1-8H,15H2 |
| InChIKey |
VIRDYRPKKYCAJQ-UHFFFAOYSA-N |
| Molecular Weight |
247.681 g/mol |
| SMILES |
C(C1=C(N)C=CC=C1)(OC1=CC=C(C=C1)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967362 |
