| SpectraBase Compound ID | 7jk2hRzJHX3 |
|---|---|
| InChI | InChI=1S/C20H22N2O3/c1-3-13-12(11-18(23)25-2)10-17-19-15(8-9-22(17)20(13)24)14-6-4-5-7-16(14)21-19/h3-7,12,17,21H,8-11H2,1-2H3/b13-3+ |
| InChIKey | JLSBXFJHYJOYLD-QLKAYGNNSA-N |
| Mol Weight | 338.41 g/mol |
| Molecular Formula | C20H22N2O3 |
| Exact Mass | 338.163043 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HoZWtt30vW1 |
|---|---|
| Name | Corynan-17-oic acid, 19,20-didehydro-21-oxo-, methyl ester, (19Z)-(.+-.)- |
| CAS Registry Number | 61756-62-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H22N2O3 |
| InChI | InChI=1S/C20H22N2O3/c1-3-13-12(11-18(23)25-2)10-17-19-15(8-9-22(17)20(13)24)14-6-4-5-7-16(14)21-19/h3-7,12,17,21H,8-11H2,1-2H3/b13-3+ |
| InChIKey | JLSBXFJHYJOYLD-QLKAYGNNSA-N |
| Molecular Weight | 338.407 g/mol |
| SMILES | [nH]1c2ccccc2c2CCN3C(c12)CC(\C(C3=O)=C\C)CC(=O)OC |
| SPLASH | splash10-00kr-0249000000-96f8dc1cc1289987858b |
| Source of Spectrum | K-109-3833-0 |
| Synonyms | Corynan-17-oic acid, 19,20-didehydro-21-oxo-, methyl ester, (19E)-(.+-.)- Methyl ester of (3E)-3-ethyliden-4-oxo-1,2,3,4,6,7,12,12b-octahydroindolo(2,3-a)quinolizin-2-methylcarboxylic acid Indolo[2,3-a]quinolizine, corynan-17-oic acid deriv. Methylester of 3-(Z)-Ethyliden-4-oxo-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolixin-2-acetic acid Methyl ester of 3-ethyliden-4-oxo-1,2,3,4,6,7,12,12b-octahydroindolo(2,3-a)quinolizin-2-methylcarboxylic acid Methyl (19E)-21-oxocoryn-19-en-17-oate Methyl ester of 3-(E)-ethyliden-4-oxo-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-acetic acid |
| Wiley ID | 1333875 |