SpectraBase Spectrum ID |
6UXZz8khDRw |
Name |
4-Cyano-6-dicyanomethyl--2-methyl-2,5-diphenyl-1,2-dihydropyridine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
336.137496531 u |
Formula |
C22H16N4 |
InChI |
InChI=1S/C22H16N4/c1-22(19-10-6-3-7-11-19)12-17(13-23)20(16-8-4-2-5-9-16)21(26-22)18(14-24)15-25/h2-12,18,26H,1H3 |
InChIKey |
MVEICMIUFLKTPV-UHFFFAOYSA-N |
Molecular Weight |
336.398 g/mol |
SMILES |
C=1(C(=CC(NC1C(C#N)C#N)(C1=CC=CC=C1)C)C#N)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.852292 |