| SpectraBase Spectrum ID |
5ZpJMnlXKnA |
| Name |
Ajmaline |
| CAS Registry Number |
4360-12-7 |
| Classification |
Kratom alkaloid |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
326.199428083 u |
| Formula |
C20H26N2O2 |
| InChI |
InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11-,14-,15-,16-,17?,18-,19+,20+/m0/s1 |
| InChIKey |
CJDRUOGAGYHKKD-UVUWSASNSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
326.440 g/mol |
| Nominal Mass |
326 u |
| Quality |
941 |
| Retention Index |
2705 |
| SMILES |
O[C@@]1([C@]23C([C@]4(N5[C@@]([C@]([C@@]([C@]1([C@@]5(C2)[H])[H])(C4)[H])(CC)[H])(O)[H])[H])N(C=1C3=CC=CC1)C)[H] |
| SPLASH |
splash10-003r-2911000000-95ddb5a473f9d50aa615 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Ajmalin
Rauwolfin
3-Ethyl-1,2,3,4,6,7,7a,12,12aalpha,12balpha-decahydro-4alpha,14-dihydroxy-12-methyl-2,6:7a,13-\rdimethano-indolo[2,3-a]quinolizine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000058 |
