![Ethyl (E)-9-(4-methylbenzylidene)-3-(3-phenylpropyl)-3-azabicyclo[3.3.1]nonane-1-carboxylate](/api/spectrum/Fvqp0ay5Fn0/structure.png?h=300&w=458 "Ethyl (E)-9-(4-methylbenzylidene)-3-(3-phenylpropyl)-3-azabicyclo[3.3.1]nonane-1-carboxylate")
| SpectraBase Compound ID | AjDZxzfcR15 |
|---|---|
| InChI | InChI=1S/C28H35NO2/c1-3-31-27(30)28-17-7-12-25(26(28)19-24-15-13-22(2)14-16-24)20-29(21-28)18-8-11-23-9-5-4-6-10-23/h4-6,9-10,13-16,19,25H,3,7-8,11-12,17-18,20-21H2,1-2H3/b26-19+/t25-,28-/m1/s1 |
| InChIKey | JZRJRVOLBOYGRD-LGUFXXKBSA-N |
| Mol Weight | 417.6 g/mol |
| Molecular Formula | C28H35NO2 |
| Exact Mass | 417.266779 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Fvqp0ay5Fn0 |
|---|---|
| Name | Ethyl (E)-9-(4-Methylbenzylidene)-3-(3-phenylpropyl)-3-azabicyclo[3.3.1]nonane-1-carboxylate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H35NO2 |
| InChI | InChI=1S/C28H35NO2/c1-3-31-27(30)28-17-7-12-25(26(28)19-24-15-13-22(2)14-16-24)20-29(21-28)18-8-11-23-9-5-4-6-10-23/h4-6,9-10,13-16,19,25H,3,7-8,11-12,17-18,20-21H2,1-2H3/b26-19+/t25-,28-/m1/s1 |
| InChIKey | JZRJRVOLBOYGRD-LGUFXXKBSA-N |
| Molecular Weight | 417.593 g/mol |
| SMILES | [C@@]12(\C(=C\c3ccc(cc3)C)[C@](CCC1)(CN(C2)CCCc1ccccc1)[H])C(=O)OCC |
| SPLASH | splash10-01ox-9304000000-f81771ad41d537d0ba91 |
| Source of Spectrum | U1-2009-1950-7h |
| Wiley ID | 1662801 |