| SpectraBase Compound ID | AHaPELPHSkg |
|---|---|
| InChI | InChI=1S/C22H36N2O/c1-13-17-6-7-18-16-5-4-14-10-15(23-3)8-9-21(14,2)19(16)11-20(25)22(17,18)12-24-13/h4,13,15-20,23-25H,5-12H2,1-3H3/t13-,15-,16-,17+,18-,19-,20+,21-,22+/m0/s1 |
| InChIKey | NAGUPBYKILHVQJ-KJCWERQGSA-N |
| Mol Weight | 344.5 g/mol |
| Molecular Formula | C22H36N2O |
| Exact Mass | 344.282764 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5qDISlBIhp0 |
|---|---|
| Name | 12.beta.-Hydroxyconimine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.282763786 u |
| Formula | C22H36N2O |
| InChI | InChI=1S/C22H36N2O/c1-13-17-6-7-18-16-5-4-14-10-15(23-3)8-9-21(14,2)19(16)11-20(25)22(17,18)12-24-13/h4,13,15-20,23-25H,5-12H2,1-3H3/t13-,15-,16-,17+,18-,19-,20+,21-,22+/m0/s1 |
| InChIKey | NAGUPBYKILHVQJ-KJCWERQGSA-N |
| Molecular Weight | 344.543 g/mol |
| SMILES | [C@@]123[C@]([C@@]4(CC=C5[C@@]([C@]4(C[C@]3(O)[H])[H])(CC[C@](NC)(C5)[H])C)[H])(CC[C@@]1([C@](C)(NC2)[H])[H])[H] |