| SpectraBase Spectrum ID |
2x4knmaSPKU |
| Name |
(4aS,9aS)-2-(t-Butyl)-10-[2'-(1'-pyrrolidinyl)ethyl]-(octahydro)-acridine-maleate |
| Alternate Name(s) |
(4aS,9aS)-2-tert-butyl-10-[2-(pyrrolidin-1-yl)ethyl]-1,2,3,4,4a,9,9a,10-octahydroacridine; butanedioate
(cis)-2-(t-Butyl)-10-[2'-(1'-pyrrolidinyl)ethyl]-(octahydro)-acridine-maleate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H40N2O4 |
| InChI |
InChI=1S/C23H36N2.C4H6O4/c1-23(2,3)20-10-11-22-19(17-20)16-18-8-4-5-9-21(18)25(22)15-14-24-12-6-7-13-24;5-3(6)1-2-4(7)8/h4-5,8-9,19-20,22H,6-7,10-17H2,1-3H3;1-2H2,(H,5,6)(H,7,8)/p-2/t19-,20?,22+;/m1./s1 |
| InChIKey |
IEYXMJCBXKAXPI-QUFNPKPLSA-L |
| Molecular Weight |
456.627 g/mol |
| SMILES |
C([O-])(=O)CCC([O-])=O.[C@@]12(N(c3c(C[C@@]2(CC(C(C)(C)C)CC1)[H])cccc3)CCN1CCCC1)[H] |
| SPLASH |
splash10-000i-9000000000-cdb474837f230ab90974 |
| Source of Spectrum |
Y4-83-27-9 |
| Wiley ID |
1513452 |
![(4aS,9aS)-2-(t-Butyl)-10-[2'-(1'-pyrrolidinyl)ethyl]-(octahydro)-acridine-maleate](/api/spectrum/2x4knmaSPKU/structure.png?h=300&w=458 "(4aS,9aS)-2-(t-Butyl)-10-[2'-(1'-pyrrolidinyl)ethyl]-(octahydro)-acridine-maleate")
