| SpectraBase Spectrum ID |
3EtFjkkbjnH |
| Name |
(E)-N-(4,4-Diethoxy-1-styrylbut-2-ynyl)-4-toluenesulfonamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
413.166079523 u |
| Formula |
C23H27NO4S |
| InChI |
InChI=1S/C23H27NO4S/c1-4-27-23(28-5-2)18-15-21(14-13-20-9-7-6-8-10-20)24-29(25,26)22-16-11-19(3)12-17-22/h6-14,16-17,21,23-24H,4-5H2,1-3H3/b14-13+ |
| InChIKey |
SIZXHLIIVNAWMA-BUHFOSPRSA-N |
| Molecular Weight |
413.532 g/mol |
| SMILES |
C(NS(C=1C=CC(=CC1)C)(=O)=O)(C#CC(OCC)OCC)\C=C\C=1C=CC=CC1 |
