| SpectraBase Compound ID | 3HFGpO1nm8I |
|---|---|
| InChI | InChI=1S/C18H18FN/c19-18-8-6-16(7-9-18)17-10-12-20(13-11-17)14-15-4-2-1-3-5-15/h1-10H,11-14H2 |
| InChIKey | LLRJZCQEHKIWCO-UHFFFAOYSA-N |
| Mol Weight | 267.35 g/mol |
| Molecular Formula | C18H18FN |
| Exact Mass | 267.142328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3bZYYNuhscD |
|---|---|
| Name | 1-Benzyl-4-(4-fluorophenyl)- 1,2,3,6-tetrahydropyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.142327747 u |
| Formula | C18H18FN |
| InChI | InChI=1S/C18H18FN/c19-18-8-6-16(7-9-18)17-10-12-20(13-11-17)14-15-4-2-1-3-5-15/h1-10H,11-14H2 |
| InChIKey | LLRJZCQEHKIWCO-UHFFFAOYSA-N |
| Molecular Weight | 267.347 g/mol |
| SMILES | C1(=CCN(CC1)CC=1C=CC=CC1)C1=CC=C(C=C1)F |