| SpectraBase Spectrum ID |
E04LLrw3reR |
| Name |
m-Nitrocarbanilic acid, phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
258.064056806 u |
| Formula |
C13H10N2O4 |
| InChI |
InChI=1S/C13H10N2O4/c16-13(19-12-7-2-1-3-8-12)14-10-5-4-6-11(9-10)15(17)18/h1-9H,(H,14,16) |
| InChIKey |
JRBQTHUEPKJNBD-UHFFFAOYSA-N |
| Molecular Weight |
258.233 g/mol |
| SMILES |
N(C1=CC=CC(=C1)N(=O)=O)C(OC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Raman) |
0.964117 |
