| SpectraBase Spectrum ID |
H929REtJ2IU |
| Name |
N-Pentyl-N-4-chlorophenyl-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 |
384.233226771 u |
| Formula |
C24H33ClN2 |
| InChI |
InChI=1S/C24H33ClN2/c1-2-3-7-17-27(23-12-10-22(25)11-13-23)24-15-19-26(20-16-24)18-14-21-8-5-4-6-9-21/h4-6,8-13,24H,2-3,7,14-20H2,1H3 |
| InChIKey |
KZMZEUMGWNXZNR-UHFFFAOYSA-N |
| Molecular Weight |
384.995 g/mol |
| SMILES |
C1(N(C=2C=CC(=CC2)Cl)CCCCC)CCN(CC1)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811028 |