| SpectraBase Spectrum ID |
24p1m4YDEGt |
| Name |
1,5,9-Benzotriazacyclododecine, 1,2,3,4,5,6,7,8,9,10-decahydro-1,5,9-tris[(4-methylphenyl)sulfonyl]- |
| Alternate Name(s) |
1,5,9-tris[(4-methylphenyl)sulfonyl]-1,2,3,4,5,6,7,8,9,10-decahydro-1,5,9-benzotriazacyclododecine
Benzo[b]-1,5,9-triacyclododecane N,N',N''-tritosylamide |
| CAS Registry Number |
112672-90-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C34H39N3O6S3 |
| InChI |
InChI=1S/C34H39N3O6S3/c1-27-10-16-31(17-11-27)44(38,39)35-22-6-24-36(45(40,41)32-18-12-28(2)13-19-32)26-30-8-4-5-9-34(30)37(25-7-23-35)46(42,43)33-20-14-29(3)15-21-33/h4-5,8-21H,6-7,22-26H2,1-3H3 |
| InChIKey |
IETRODQXBKOPML-UHFFFAOYSA-N |
| Molecular Weight |
681.881 g/mol |
| SMILES |
c12N(S(c3ccc(cc3)C)(=O)=O)CCCN(CCCN(Cc1cccc2)S(c1ccc(cc1)C)(=O)=O)S(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-0006-9440030000-09276285b770df5b2e4c |
| Source of Spectrum |
F-43-1911-8 |
| Wiley ID |
1414368 |
![1,5,9-Benzotriazacyclododecine, 1,2,3,4,5,6,7,8,9,10-decahydro-1,5,9-tris[(4-methylphenyl)sulfonyl]-](/api/spectrum/24p1m4YDEGt/structure.png?h=300&w=458 "1,5,9-Benzotriazacyclododecine, 1,2,3,4,5,6,7,8,9,10-decahydro-1,5,9-tris[(4-methylphenyl)sulfonyl]-")
