SpectraBase Spectrum ID |
8mh2TRiGlYc |
Name |
N-(4-Fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl] 4'-methoxy-benzamide I |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
432.221306343 u |
Formula |
C27H29FN2O2 |
InChI |
InChI=1S/C27H29FN2O2/c1-32-26-13-7-22(8-14-26)27(31)30(24-11-9-23(28)10-12-24)25-16-19-29(20-17-25)18-15-21-5-3-2-4-6-21/h2-14,25H,15-20H2,1H3 |
InChIKey |
ZRPDEHQKHNTRQU-UHFFFAOYSA-N |
Molecular Weight |
432.539 g/mol |
SMILES |
C(N(C1CCN(CC1)CCC=1C=CC=CC1)C=1C=CC(=CC1)F)(C=1C=CC(=CC1)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909378 |