| SpectraBase Spectrum ID |
JF9hhE7zJB2 |
| Name |
Emetine |
| CAS Registry Number |
483-18-1 |
| Classification |
Pharmaceutical drug, anti-amoebic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
480.298807772 u |
| Formula |
C29H40N2O4 |
| InChI |
InChI=1S/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3/t18-,21-,24+,25-/m0/s1 |
| InChIKey |
AUVVAXYIELKVAI-CKBKHPSWSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
480.649 g/mol |
| Nominal Mass |
480 u |
| Quality |
881 |
| Retention Index |
3753 |
| SMILES |
[C@@]12(C=3C(=CC(=C(C3)OC)OC)CCN1C[C@@]([C@](C2)(C[C@@]1(C2=C(C=C(C(=C2)OC)OC)CCN1)[H])[H])(CC)[H])[H] |
| SPLASH |
splash10-0006-1940000000-863e95997dd0d49ed531 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6',7',10,11-Tetramethoxyemetan |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001278 |
