SpectraBase Spectrum ID |
EdfnNhxIBVr |
Name |
Ajmaline |
CAS Registry Number |
4360-12-7 |
Classification |
Antiarrhythmic |
Copyright |
Copyright © 2023-2024 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-LYWHTSDUSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
326.440 g/mol |
SMILES |
CCC1[C@]2(C3C(O)C45C([C@](N(C3C5)C1O)(C2)[H])N(C)c1c4cccc1)[H] |
SPLASH |
splash10-002f-0922000000-b754eab62a08880ff768 |
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. |
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_2719 |