| SpectraBase Spectrum ID |
3mpwlD2JseW |
| Name |
1,4-Diisopropyl-7-(p-methoxybenzyl)-1,4,7-triazacyclononane |
| Alternate Name(s) |
1,4-diisopropyl-7-(4-methoxybenzyl)octahydro-1H-1,4,7-triazonine
4-[(4,7-diisopropyloctahydro-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 |
C20H35N3O |
| InChI |
InChI=1S/C20H35N3O/c1-17(2)22-12-10-21(11-13-23(15-14-22)18(3)4)16-19-6-8-20(24-5)9-7-19/h6-9,17-18H,10-16H2,1-5H3 |
| InChIKey |
VOJPVRBVGKPQPK-UHFFFAOYSA-N |
| Molecular Weight |
333.520 g/mol |
| SMILES |
C1N(CCN(CCN(C1)C(C)C)Cc1ccc(cc1)OC)C(C)C |
| SPLASH |
splash10-00di-0900000000-ccf5d2f031ff904353c8 |
| Source of Spectrum |
C-118-11585-0 |
| Wiley ID |
760084 |
