| SpectraBase Spectrum ID |
5Ri0IUFNA0j |
| Name |
5H-Cyclooct[b]indole-9-carboxylic acid, 8-[1-[(dimethylamino)methyl]propyl]-6,7,8,9-tetrahydro-6-oxo-, methyl ester, [8S-[8.alpha.(S*),9.beta.]]- |
| CAS Registry Number |
57605-82-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O3 |
| InChI |
InChI=1S/C22H28N2O3/c1-5-14(13-24(2)3)18-12-20(25)21-16(10-11-17(18)22(26)27-4)15-8-6-7-9-19(15)23-21/h6-11,14,17-18,23H,5,12-13H2,1-4H3/b11-10-/t14?,17-,18+/m1/s1 |
| InChIKey |
LFMCNWUPIUPRCC-HXZBMTOGSA-N |
| Molecular Weight |
368.477 g/mol |
| SMILES |
[nH]1c2ccccc2c2c1C(C[C@]([C@@](\C=C/2)(C(=O)OC)[H])(C(CN(C)C)CC)[H])=O |
| SPLASH |
splash10-0aor-9205000000-578964c9d1d6639439d3 |
| Source of Spectrum |
B-28-1853-0 |
| Synonyms |
Dregamine methine
Methyl (8S,9R)-8-{1-[(dimethylamino)methyl]propyl}-6-oxo-6,7,8,9-tetrahydro-5H-cycloocta[b]indole-9-carboxylate |
| Wiley ID |
1353235 |
![5H-Cyclooct[b]indole-9-carboxylic acid, 8-[1-[(dimethylamino)methyl]propyl]-6,7,8,9-tetrahydro-6-oxo-, methyl ester, [8S-[8.alpha.(S*),9.beta.]]-](/api/spectrum/5Ri0IUFNA0j/structure.png?h=300&w=458 "5H-Cyclooct[b]indole-9-carboxylic acid, 8-[1-[(dimethylamino)methyl]propyl]-6,7,8,9-tetrahydro-6-oxo-, methyl ester, [8S-[8.alpha.(S*),9.beta.]]-")
