SpectraBase Spectrum ID |
5QHCuT0oyxr |
Name |
N-(1-Benzylpiperidin-4-yl)-N-(3-fluorophenyl)acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
326.179441531 u |
Formula |
C20H23FN2O |
InChI |
InChI=1S/C20H23FN2O/c1-16(24)23(20-9-5-8-18(21)14-20)19-10-12-22(13-11-19)15-17-6-3-2-4-7-17/h2-9,14,19H,10-13,15H2,1H3 |
InChIKey |
OETFUCVABIRGCG-UHFFFAOYSA-N |
Molecular Weight |
326.415 g/mol |
SMILES |
C1(N(C2CCN(CC3=CC=CC=C3)CC2)C(=O)C)=CC(=CC=C1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953744 |