| SpectraBase Spectrum ID |
1D0bCpdQRif |
| Name |
N-(1-Benzylpiperidin-4-yl)-N-(2-fluorophenyl)butanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.210741659 u |
| Formula |
C22H27FN2O |
| InChI |
InChI=1S/C22H27FN2O/c1-2-8-22(26)25(21-12-7-6-11-20(21)23)19-13-15-24(16-14-19)17-18-9-4-3-5-10-18/h3-7,9-12,19H,2,8,13-17H2,1H3 |
| InChIKey |
JWSJYZXIWWKBJE-UHFFFAOYSA-N |
| Molecular Weight |
354.469 g/mol |
| SMILES |
C=1(N(C2CCN(CC3=CC=CC=C3)CC2)C(CCC)=O)C(=CC=CC1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899013 |
