| SpectraBase Spectrum ID |
2IhpCp9lAFf |
| Name |
2-Chloro-4-nitrocarbanilic acid, o-fluorobenzyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.031312669 u |
| Formula |
C14H10ClFN2O4 |
| InChI |
InChI=1S/C14H10ClFN2O4/c15-11-7-10(18(20)21)5-6-13(11)17-14(19)22-8-9-3-1-2-4-12(9)16/h1-7H,8H2,(H,17,19) |
| InChIKey |
CNRAENCZXSDDKP-UHFFFAOYSA-N |
| Molecular Weight |
324.695 g/mol |
| SMILES |
N(C1=CC=C(C=C1Cl)N(=O)=O)C(OCC=1C(=CC=CC1)F)=O |
| Spectrum/Structure Validation Score (Raman) |
0.779333 |
