| SpectraBase Spectrum ID |
2p1L3N2E6ee |
| Name |
Desethylchloroquine |
| CAS Registry Number |
1476-52-4 |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
291.150225420 u |
| Formula |
C16H22ClN3 |
| InChI |
InChI=1S/C16H22ClN3/c1-3-18-9-4-5-12(2)20-15-8-10-19-16-11-13(17)6-7-14(15)16/h6-8,10-12,18H,3-5,9H2,1-2H3,(H,19,20) |
| InChIKey |
MCYUUUTUAAGOOT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
291.826 g/mol |
| Nominal Mass |
291 u |
| Quality |
899 |
| Retention Index |
2377 |
| SMILES |
C=1(C2=C(C=C(C=C2)Cl)N=CC1)NC(CCCNCC)C |
| SPLASH |
splash10-0a6r-5940000000-d46dc1e206596b34e036 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Chloroquine-M
N'-(7-Chloroquinolin-4-yl)-N-ethyl-pentane-1,4-diamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000856 |
