| SpectraBase Spectrum ID |
ITkug7g2pkN |
| Name |
4-Nitrobenzamide, N-(2-fluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.059720318 u |
| Formula |
C13H9FN2O3 |
| InChI |
InChI=1S/C13H9FN2O3/c14-11-3-1-2-4-12(11)15-13(17)9-5-7-10(8-6-9)16(18)19/h1-8H,(H,15,17) |
| InChIKey |
WRVHMPQODZMFPO-UHFFFAOYSA-N |
| Molecular Weight |
260.224 g/mol |
| SMILES |
C1=CC(=CC=C1C(=O)NC1=CC=CC=C1F)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.890886 |
