| SpectraBase Spectrum ID |
6yeBcUlaYXj |
| Name |
2-Benzyl-p-nitro-4-pentenanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.131742445 u |
| Formula |
C18H18N2O3 |
| InChI |
InChI=1S/C18H18N2O3/c1-2-6-15(13-14-7-4-3-5-8-14)18(21)19-16-9-11-17(12-10-16)20(22)23/h2-5,7-12,15H,1,6,13H2,(H,19,21) |
| InChIKey |
XFCMKGJQPLEUME-UHFFFAOYSA-N |
| Molecular Weight |
310.353 g/mol |
| SMILES |
N(C1=CC=C(C=C1)N(=O)=O)C(C(CC=1C=CC=CC1)CC=C)=O |
| Spectrum/Structure Validation Score (Raman) |
0.9115 |
