![cis-3-(Diphenylethylene)octahydro-N-[(2-methoxyphenylmethyl]-1H-2,5-methanoisoquinolin-4-amine](/api/spectrum/BZEJ0ccpvU6/structure.png?h=300&w=458 "cis-3-(Diphenylethylene)octahydro-N-[(2-methoxyphenylmethyl]-1H-2,5-methanoisoquinolin-4-amine")
| SpectraBase Compound ID | I9J3isxiIXG |
|---|---|
| InChI | InChI=1S/C31H36N2O/c1-34-27-18-9-8-15-24(27)19-32-30-28-25-16-10-17-26(28)21-33(20-25)31(30)29(22-11-4-2-5-12-22)23-13-6-3-7-14-23/h2-9,11-15,18,25-26,28-32H,10,16-17,19-21H2,1H3/t25-,26+,28+,30-,31-/m0/s1 |
| InChIKey | VHGKPNMPOKTFMD-YLXXWHEUSA-N |
| Mol Weight | 452.6 g/mol |
| Molecular Formula | C31H36N2O |
| Exact Mass | 452.282764 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BZEJ0ccpvU6 |
|---|---|
| Name | cis-3-(Diphenylethylene)octahydro-N-[(2-methoxyphenylmethyl]-1H-2,5-methanoisoquinolin-4-amine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H36N2O |
| InChI | InChI=1S/C31H36N2O/c1-34-27-18-9-8-15-24(27)19-32-30-28-25-16-10-17-26(28)21-33(20-25)31(30)29(22-11-4-2-5-12-22)23-13-6-3-7-14-23/h2-9,11-15,18,25-26,28-32H,10,16-17,19-21H2,1H3/t25-,26+,28+,30-,31-/m0/s1 |
| InChIKey | VHGKPNMPOKTFMD-YLXXWHEUSA-N |
| Molecular Weight | 452.642 g/mol |
| SMILES | N([C@@]1([C@@](N2C[C@]3(CCC[C@]([C@]13[H])(C2)[H])[H])(C(c1ccccc1)c1ccccc1)[H])[H])Cc1c(OC)cccc1 |
| SPLASH | splash10-000i-4894000000-fb3d64c0f8a06208591d |
| Source of Spectrum | E1-37-2838-23 |
| Wiley ID | 1575268 |