| SpectraBase Spectrum ID |
1MMO6jsIyIn |
| Name |
Chloroquine |
| CAS Registry Number |
54-05-7 |
| Classification |
Antimalarial |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
319.181525549 u |
| Formula |
C18H26ClN3 |
| InChI |
InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21) |
| InChIKey |
WHTVZRBIWZFKQO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
319.880 g/mol |
| SMILES |
CCN(CCCC(Nc1c2c(ncc1)cc(cc2)Cl)C)CC |
| SPLASH |
splash10-000i-9321000000-b63f60a2bbad235a730d |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: P G U |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_677 |
