SpectraBase Spectrum ID |
Djfbr5V3IyV |
Name |
4-Methyl-N-(2-nitrophenyl)benzamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
256.084792251 u |
Formula |
C14H12N2O3 |
InChI |
InChI=1S/C14H12N2O3/c1-10-6-8-11(9-7-10)14(17)15-12-4-2-3-5-13(12)16(18)19/h2-9H,1H3,(H,15,17) |
InChIKey |
BZWSTMONQJLXQY-UHFFFAOYSA-N |
Molecular Weight |
256.261 g/mol |
SMILES |
C1(=C(C=CC=C1)NC(C1=CC=C(C=C1)C)=O)N(=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93744 |