| SpectraBase Spectrum ID |
BK1HPa4HrMg |
| Name |
N,N-Hexyl-(4-methylphenyl)-1-(2-phenylethyl)piperidin-4-amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.303499232 u |
| Formula |
C26H38N2 |
| InChI |
InChI=1S/C26H38N2/c1-3-4-5-9-19-28(25-14-12-23(2)13-15-25)26-17-21-27(22-18-26)20-16-24-10-7-6-8-11-24/h6-8,10-15,26H,3-5,9,16-22H2,1-2H3 |
| InChIKey |
GRKLKPLMNGQEJB-UHFFFAOYSA-N |
| Molecular Weight |
378.604 g/mol |
| SMILES |
C1(N(C2=CC=C(C=C2)C)CCCCCC)CCN(CC1)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947394 |
