| SpectraBase Spectrum ID |
8G6kkytyZbl |
| Name |
1-Chloro-1-phenyl-2-[p-nitrobenzenesulfonyl]ethane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.017556740 u |
| Formula |
C14H12ClNO4S |
| InChI |
InChI=1S/C14H12ClNO4S/c15-14(11-4-2-1-3-5-11)10-21(19,20)13-8-6-12(7-9-13)16(17)18/h1-9,14H,10H2 |
| InChIKey |
DOVCSFCXQWKXEM-UHFFFAOYSA-N |
| Molecular Weight |
325.766 g/mol |
| SMILES |
C1(N(=O)=O)=CC=C(S(=O)(=O)CC(Cl)C2=CC=CC=C2)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897873 |
![1-Chloro-1-phenyl-2-[p-nitrobenzenesulfonyl]ethane](/api/spectrum/8G6kkytyZbl/structure.png?h=300&w=458 "1-Chloro-1-phenyl-2-[p-nitrobenzenesulfonyl]ethane")
