| SpectraBase Spectrum ID |
3RhrUKBJEPU |
| Name |
Propanamide, 3-[(2-amino-5-nitrophenyl)sulfonyl]-N-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.073241764 u |
| Formula |
C15H15N3O5S |
| InChI |
InChI=1S/C15H15N3O5S/c16-13-7-6-12(18(20)21)10-14(13)24(22,23)9-8-15(19)17-11-4-2-1-3-5-11/h1-7,10H,8-9,16H2,(H,17,19) |
| InChIKey |
PZPGLIGYGMOTQN-UHFFFAOYSA-N |
| Molecular Weight |
349.361 g/mol |
| SMILES |
C1(N)=CC=C(C=C1S(=O)(=O)CCC(=O)NC1=CC=CC=C1)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950925 |