SpectraBase Spectrum ID |
1Bw2AQXha4u |
Name |
1-[(1,2-Diphenylethyl)amino]cyclopentanecarbonitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.178298716 u |
Formula |
C20H22N2 |
InChI |
InChI=1S/C20H22N2/c21-16-20(13-7-8-14-20)22-19(18-11-5-2-6-12-18)15-17-9-3-1-4-10-17/h1-6,9-12,19,22H,7-8,13-15H2 |
InChIKey |
TUWNLCIPDGATAK-UHFFFAOYSA-N |
Molecular Weight |
290.410 g/mol |
SMILES |
N(C(C1=CC=CC=C1)CC=1C=CC=CC1)C1(CCCC1)C#N |
Spectrum/Structure Validation Score (Raman) |
0.995634 |