SpectraBase Spectrum ID |
FXIqhoAwT6y |
Name |
5-Cyano-4,5-diphenyl-1-methyl-4-.alpha.-pyridyl-.delta.2-imidazoline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
338.153146596 u |
Formula |
C22H18N4 |
InChI |
InChI=1S/C22H18N4/c1-26-17-25-22(19-12-6-3-7-13-19,20-14-8-9-15-24-20)21(26,16-23)18-10-4-2-5-11-18/h2-15,17H,1H3/t21?,22-/m1/s1 |
InChIKey |
QKZSQVKXPBZUAW-FOIFJWKZSA-N |
Molecular Weight |
338.414 g/mol |
SMILES |
[C@@]1(C(N(C)C=N1)(C#N)C1=CC=CC=C1)(C1=NC=CC=C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948472 |