| SpectraBase Spectrum ID |
1DGgJaZEfQb |
| Name |
1,4-Diisopropyl-7-(p-tolylsullfonyl)-1,4,7-triazacyclononane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H33N3O2S |
| InChI |
InChI=1S/C19H33N3O2S/c1-16(2)20-10-11-21(17(3)4)13-15-22(14-12-20)25(23,24)19-8-6-18(5)7-9-19/h6-9,16-17H,10-15H2,1-5H3 |
| InChIKey |
YVZJOSDAKCPJAT-UHFFFAOYSA-N |
| Molecular Weight |
367.552 g/mol |
| SMILES |
C1N(S(c2ccc(cc2)C)(=O)=O)CCN(CCN(C1)C(C)C)C(C)C |
| SPLASH |
splash10-0006-0900000000-6131c02be6593de7a8a6 |
| Source of Spectrum |
C-118-11571-0 |
| Synonyms |
1,4-diisopropyl-7-[(4-methylphenyl)sulfonyl]octahydro-1H-1,4,7-triazonine |
| Wiley ID |
760088 |
