| SpectraBase Spectrum ID |
2XcKV220ful |
| Name |
4-Nitrobenzamide, N-methallyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.084792251 u |
| Formula |
C11H12N2O3 |
| InChI |
InChI=1S/C11H12N2O3/c1-8(2)7-12-11(14)9-3-5-10(6-4-9)13(15)16/h3-6H,1,7H2,2H3,(H,12,14) |
| InChIKey |
LFVYVWGBIJYANG-UHFFFAOYSA-N |
| Molecular Weight |
220.228 g/mol |
| SMILES |
C1=CC(=CC=C1C(=O)NCC(=C)C)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905107 |
