SpectraBase Spectrum ID |
5fPiant7lzH |
Name |
N-(2,2,-Dimethyl-6-phenyl-3,5-hexadien-3-yl)-1-piperidinecarboxamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
312.220163529 u |
Formula |
C20H28N2O |
InChI |
InChI=1S/C20H28N2O/c1-20(2,3)18(14-10-13-17-11-6-4-7-12-17)21-19(23)22-15-8-5-9-16-22/h4,6-7,10-14H,5,8-9,15-16H2,1-3H3,(H,21,23)/b13-10+,18-14+ |
InChIKey |
ZUNATTRFYBZCTM-BHTJOUODSA-N |
Molecular Weight |
312.457 g/mol |
SMILES |
C(N\C(C(C)(C)C)=C/C=C/C=1C=CC=CC1)(N1CCCCC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.884961 |