| SpectraBase Spectrum ID |
53vTX1wQCMw |
| Name |
(E)-N-Benzyl-3-(p-chlorobenzenesulfonyl)azacyclotetradecane |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
461.215528275 u |
| Formula |
C26H36ClNO2S |
| InChI |
InChI=1S/C26H36ClNO2S/c27-24-16-18-25(19-17-24)31(29,30)26-15-11-6-4-2-1-3-5-7-12-20-28(22-26)21-23-13-9-8-10-14-23/h8-10,13-14,16-19,26H,1-7,11-12,15,20-22H2 |
| InChIKey |
WDNBTNYHZLVNLF-UHFFFAOYSA-N |
| Molecular Weight |
462.092 g/mol |
| SMILES |
C1(S(C2=CC=C(C=C2)Cl)(=O)=O)CN(CC=2C=CC=CC2)CCCCCCCCCCC1 |
