| SpectraBase Spectrum ID |
BH9QLOIJZSx |
| Name |
6-Oxoibogaine |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24N2O2 |
| InChI |
InChI=1S/C20H24N2O2/c1-3-12-6-11-7-15-19-18(17(23)10-22(9-11)20(12)15)14-8-13(24-2)4-5-16(14)21-19/h4-5,8,11-12,15,20-21H,3,6-7,9-10H2,1-2H3/t11-,12+,15+,20+/m1/s1 |
| InChIKey |
KQABPFRLIMUVDP-AKSXLEGCSA-N |
| Instrument Name |
OIC Organic |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.5b00117 |
| Molecular Weight |
324.424 g/mol |
| Optical Rotation |
[a]D25 = +43 (c = 0.1, CHCl3) |
| Reported Formula |
C20H24N2O2 |
| SMILES |
[nH]1c2c(c3cc(ccc13)OC)C(CN1[C@]3([C@](C[C@](C[C@@]23[H])(C1)[H])(CC)[H])[H])=O |
| SPLASH |
splash10-0079-0922000000-424871f1c7535d5ff60c |
| Source of Spectrum |
G4-78-1136-5 |
| Wiley ID |
1865864 |
