| SpectraBase Spectrum ID |
J5qYroip7Wm |
| Name |
1-[2-(4-Fluorophenyl)ethyl]-N-phenyl-N-([4-(trifluoromethyl)phenyl]methyl)piperidin-4-amine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
456.218861562 u |
| Formula |
C27H28F4N2 |
| InChI |
InChI=1S/C27H28F4N2/c28-24-12-8-21(9-13-24)14-17-32-18-15-26(16-19-32)33(25-4-2-1-3-5-25)20-22-6-10-23(11-7-22)27(29,30)31/h1-13,26H,14-20H2 |
| InChIKey |
IKAQUQBWVQKVAZ-UHFFFAOYSA-N |
| Molecular Weight |
456.529 g/mol |
| SMILES |
C1(N(C2=CC=CC=C2)CC2=CC=C(C(F)(F)F)C=C2)CCN(CC1)CCC1=CC=C(C=C1)F |