SpectraBase Spectrum ID |
AaT4nijther |
Name |
N-(4-Methylphenyl)-N-(1-phenyl-2-cyclopopylethyl)amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
251.167399680 u |
Formula |
C18H21N |
InChI |
InChI=1S/C18H21N/c1-14-7-11-17(12-8-14)19-18(13-15-9-10-15)16-5-3-2-4-6-16/h2-8,11-12,15,18-19H,9-10,13H2,1H3 |
InChIKey |
CAGUTIYBAGGVDV-UHFFFAOYSA-N |
Molecular Weight |
251.373 g/mol |
SMILES |
C(NC1=CC=C(C=C1)C)(CC1CC1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847082 |