SpectraBase Spectrum ID |
2BhmoQAYLqm |
Name |
p-(o-Chlorobenzamido)benzoic acid, ethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
303.066221012 u |
Formula |
C16H14ClNO3 |
InChI |
InChI=1S/C16H14ClNO3/c1-2-21-16(20)11-7-9-12(10-8-11)18-15(19)13-5-3-4-6-14(13)17/h3-10H,2H2,1H3,(H,18,19) |
InChIKey |
JTJUVXPRZUGBSK-UHFFFAOYSA-N |
SMILES |
N(C(C1=CC=CC=C1Cl)=O)C=1C=CC(=CC1)C(OCC)=O |
Spectrum/Structure Validation Score (Raman) |
0.82824 |