SpectraBase Spectrum ID |
1oBE2u2m6bh |
Name |
N-(3-Fluorophenyl)-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)prop-2-enamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
370.185669726 u |
Formula |
C22H24F2N2O |
InChI |
InChI=1S/C22H24F2N2O/c1-2-22(27)26(21-5-3-4-19(24)16-21)20-11-14-25(15-12-20)13-10-17-6-8-18(23)9-7-17/h2-9,16,20H,1,10-15H2 |
InChIKey |
LKCJFOLSZRHMNO-UHFFFAOYSA-N |
Molecular Weight |
370.444 g/mol |
SMILES |
C=1(N(C2CCN(CC2)CCC=2C=CC(=CC2)F)C(C=C)=O)C=C(C=CC1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.865285 |