![cis-3-(Diphenylethylene)octahydro-N-[[4-(trifluoromethyl)phenyl]methyl]-1H-2,5-methanoisoquinolin-4-amine](/api/spectrum/Ham7mJypPV8/structure.png?h=300&w=458 "cis-3-(Diphenylethylene)octahydro-N-[[4-(trifluoromethyl)phenyl]methyl]-1H-2,5-methanoisoquinolin-4-amine")
| SpectraBase Compound ID | 6qxD7VUwzUN |
|---|---|
| InChI | InChI=1S/C31H33F3N2/c32-31(33,34)26-17-8-7-14-23(26)18-35-29-27-24-15-9-16-25(27)20-36(19-24)30(29)28(21-10-3-1-4-11-21)22-12-5-2-6-13-22/h1-8,10-14,17,24-25,27-30,35H,9,15-16,18-20H2/t24-,25+,27+,29-,30-/m0/s1 |
| InChIKey | GXTSWQHJNXPRMX-FNHDUMSZSA-N |
| Mol Weight | 490.6 g/mol |
| Molecular Formula | C31H33F3N2 |
| Exact Mass | 490.259584 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ham7mJypPV8 |
|---|---|
| Name | cis-3-(Diphenylethylene)octahydro-N-[[4-(trifluoromethyl)phenyl]methyl]-1H-2,5-methanoisoquinolin-4-amine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H33F3N2 |
| InChI | InChI=1S/C31H33F3N2/c32-31(33,34)26-17-8-7-14-23(26)18-35-29-27-24-15-9-16-25(27)20-36(19-24)30(29)28(21-10-3-1-4-11-21)22-12-5-2-6-13-22/h1-8,10-14,17,24-25,27-30,35H,9,15-16,18-20H2/t24-,25+,27+,29-,30-/m0/s1 |
| InChIKey | GXTSWQHJNXPRMX-FNHDUMSZSA-N |
| Molecular Weight | 490.614 g/mol |
| SMILES | N([C@@]1([C@@](N2C[C@@]3(CCC[C@@]([C@]13[H])(C2)[H])[H])(C(c1ccccc1)c1ccccc1)[H])[H])Cc1c(C(F)(F)F)cccc1 |
| SPLASH | splash10-0089-0309000000-aa0d07a7d5cf74ea9dee |
| Source of Spectrum | E1-37-2838-25 |
| Wiley ID | 1575266 |