| SpectraBase Spectrum ID |
yQn5LgoD1R |
| Name |
Quinine |
| CAS Registry Number |
130-95-0 |
| Classification |
Antimalarial |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
324.183778019 u |
| Formula |
C20H24N2O2 |
| InChI |
InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14+,19?,20?/m1/s1 |
| InChIKey |
LOUPRKONTZGTKE-AGPHHVQXSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
324.424 g/mol |
| SMILES |
c1(ccnc2c1cc(cc2)OC)C(O)C1N2CC[C@@](C1)([C@@](C2)(C=C)[H])[H] |
| SPLASH |
splash10-000i-2900000000-cda2dda67b5b67766530 |
| 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: G P-I 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_668 |
