![Ethyl (E)-9-(3-Methoxybenzylidene)-3-(3-phenylpropyl)-3-azabicyclo[3.3.1]nonane-1-carboxylate](/api/spectrum/GY4tUiYCYBS/structure.png?h=300&w=458 "Ethyl (E)-9-(3-Methoxybenzylidene)-3-(3-phenylpropyl)-3-azabicyclo[3.3.1]nonane-1-carboxylate")
| SpectraBase Compound ID | 8bjJyZNLPZ3 |
|---|---|
| InChI | InChI=1S/C28H35NO3/c1-3-32-27(30)28-16-8-14-24(26(28)19-23-12-7-15-25(18-23)31-2)20-29(21-28)17-9-13-22-10-5-4-6-11-22/h4-7,10-12,15,18-19,24H,3,8-9,13-14,16-17,20-21H2,1-2H3/b26-19+/t24-,28-/m1/s1 |
| InChIKey | KOUAEMVHFVYCSQ-YWRAUYEXSA-N |
| Mol Weight | 433.6 g/mol |
| Molecular Formula | C28H35NO3 |
| Exact Mass | 433.261694 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GY4tUiYCYBS |
|---|---|
| Name | Ethyl (E)-9-(3-Methoxybenzylidene)-3-(3-phenylpropyl)-3-azabicyclo[3.3.1]nonane-1-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H35NO3 |
| InChI | InChI=1S/C28H35NO3/c1-3-32-27(30)28-16-8-14-24(26(28)19-23-12-7-15-25(18-23)31-2)20-29(21-28)17-9-13-22-10-5-4-6-11-22/h4-7,10-12,15,18-19,24H,3,8-9,13-14,16-17,20-21H2,1-2H3/b26-19+/t24-,28-/m1/s1 |
| InChIKey | KOUAEMVHFVYCSQ-YWRAUYEXSA-N |
| Molecular Weight | 433.592 g/mol |
| SMILES | [C@@]12(\C(=C\c3cc(OC)ccc3)[C@](CCC1)(CN(C2)CCCc1ccccc1)[H])C(=O)OCC |
| SPLASH | splash10-004i-0109300000-3d90ee949f1210706d7b |
| Source of Spectrum | U1-2009-1949-7f |
| Wiley ID | 1662803 |