| SpectraBase Compound ID | HicpHoPRyTk |
|---|---|
| InChI | InChI=1S/C18H20FN/c19-17-10-6-7-15(13-17)14-18(20-11-4-5-12-20)16-8-2-1-3-9-16/h1-3,6-10,13,18H,4-5,11-12,14H2 |
| InChIKey | NARLHCZDCHFDHH-UHFFFAOYSA-N |
| Mol Weight | 269.36 g/mol |
| Molecular Formula | C18H20FN |
| Exact Mass | 269.157978 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LfYoBb8WYUL |
|---|---|
| Name | 1-Phenyl-1-pyrrolidino-2-(3-fluorophenyl)ethane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.157977811 u |
| Formula | C18H20FN |
| InChI | InChI=1S/C18H20FN/c19-17-10-6-7-15(13-17)14-18(20-11-4-5-12-20)16-8-2-1-3-9-16/h1-3,6-10,13,18H,4-5,11-12,14H2 |
| InChIKey | NARLHCZDCHFDHH-UHFFFAOYSA-N |
| Molecular Weight | 269.363 g/mol |
| SMILES | C(N1CCCC1)(C1=CC=CC=C1)CC1=CC(=CC=C1)F |