| SpectraBase Compound ID | EtMzT0BK058 |
|---|---|
| InChI | InChI=1S/C21H24N2O3/c1-26-19(25)16-17(24)13-11-21(16)20(14-6-2-3-7-15(14)22-21)8-10-23-9-4-5-12(13)18(20)23/h2-7,12-13,16-18,22,24H,8-11H2,1H3/t12?,13-,16-,17+,18?,20?,21+/m0/s1 |
| InChIKey | YSSXMQWUQXZYJB-BTCWLPBSSA-N |
| Mol Weight | 352.43 g/mol |
| Molecular Formula | C21H24N2O3 |
| Exact Mass | 352.178693 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GvUwKloQtk7 |
|---|---|
| Name | 16-(epi)-17.alpha.-hydroxy-.delta(14,15).-kopsinine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H24N2O3 |
| InChI | InChI=1S/C21H24N2O3/c1-26-19(25)16-17(24)13-11-21(16)20(14-6-2-3-7-15(14)22-21)8-10-23-9-4-5-12(13)18(20)23/h2-7,12-13,16-18,22,24H,8-11H2,1H3/t12?,13-,16-,17+,18?,20?,21+/m0/s1 |
| InChIKey | YSSXMQWUQXZYJB-BTCWLPBSSA-N |
| Molecular Weight | 352.434 g/mol |
| SMILES | O[C@@]1([C@@]2(C3C=CCN4C3C3([C@@](C2)([C@@]1(C(=O)OC)[H])Nc1ccccc31)CC4)[H])[H] |
| SPLASH | splash10-0udr-0925000000-39febad3f5f2c4ea866a |
| Source of Spectrum | X2-56-2169-3 |
| Wiley ID | 1605286 |