| SpectraBase Spectrum ID |
1Srg5WL81yb |
| Name |
N-[4'-(Phenylsulphonyl)phenyl]-4-nitro-cinnamamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
408.077992792 u |
| Formula |
C21H16N2O5S |
| InChI |
InChI=1S/C21H16N2O5S/c24-21(15-8-16-6-11-18(12-7-16)23(25)26)22-17-9-13-20(14-10-17)29(27,28)19-4-2-1-3-5-19/h1-15H,(H,22,24)/b15-8+ |
| InChIKey |
ADKQKWTYJFCTTM-OVCLIPMQSA-N |
| Molecular Weight |
408.428 g/mol |
| SMILES |
C(\C=C\C=1C=CC(=CC1)[N+](=O)[O-])(=O)NC=1C=CC(=CC1)S(=O)(C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826259 |
![N-[4'-(Phenylsulphonyl)phenyl]-4-nitro-cinnamamide](/api/spectrum/1Srg5WL81yb/structure.png?h=300&w=458 "N-[4'-(Phenylsulphonyl)phenyl]-4-nitro-cinnamamide")
