| SpectraBase Spectrum ID |
3G2Jaw36gPc |
| Name |
N-(4-Methylbenzyl)-N-(1-(2-phenylethyl)-4-piperidyl)pentanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.282763786 u |
| Formula |
C26H36N2O |
| InChI |
InChI=1S/C26H36N2O/c1-3-4-10-26(29)28(21-24-13-11-22(2)12-14-24)25-16-19-27(20-17-25)18-15-23-8-6-5-7-9-23/h5-9,11-14,25H,3-4,10,15-21H2,1-2H3 |
| InChIKey |
JKJYTEFVSCNLFM-UHFFFAOYSA-N |
| Molecular Weight |
392.587 g/mol |
| SMILES |
C1(N(CC2=CC=C(C=C2)C)C(CCCC)=O)CCN(CC1)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9566 |