| SpectraBase Spectrum ID |
I2XSZzZXzHp |
| Name |
1-Isopropyl-7-(p-methoxybenzyl)-1,4,7-triazacyclononane |
| Alternate Name(s) |
1-isopropyl-4-(4-methoxybenzyl)octahydro-1H-1,4,7-triazonine
4-[(4-isopropyloctahydro-1H-1,4,7-triazonin-1-yl)methyl]phenyl methyl ether |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H29N3O |
| InChI |
InChI=1S/C17H29N3O/c1-15(2)20-11-9-18-8-10-19(12-13-20)14-16-4-6-17(21-3)7-5-16/h4-7,15,18H,8-14H2,1-3H3 |
| InChIKey |
CHRRDFREHACSBH-UHFFFAOYSA-N |
| Molecular Weight |
291.439 g/mol |
| SMILES |
N1CCN(CCN(CC1)C(C)C)Cc1ccc(cc1)OC |
| SPLASH |
splash10-00di-0900000000-0cdd11e3e6890dcb2764 |
| Source of Spectrum |
C-118-11585-0 |
| Wiley ID |
760078 |
