| SpectraBase Spectrum ID |
2v0J1RZ0x9R |
| Name |
2,3-Dimethyl-1,5-diphenyl-2,4-diazabicyclo[3.2.0]hept-3-ene-6-carbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
301.157897624 u |
| Formula |
C20H19N3 |
| InChI |
InChI=1S/C20H19N3/c1-15-22-20(17-11-7-4-8-12-17)18(14-21)13-19(20,23(15)2)16-9-5-3-6-10-16/h3-12,18H,13H2,1-2H3 |
| InChIKey |
PQGDAXLMNQCVIY-UHFFFAOYSA-N |
| Molecular Weight |
301.393 g/mol |
| SMILES |
C12(C(N(C)C(=N2)C)(C=2C=CC=CC2)CC1C#N)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945653 |
![2,3-Dimethyl-1,5-diphenyl-2,4-diazabicyclo[3.2.0]hept-3-ene-6-carbonitrile](/api/spectrum/2v0J1RZ0x9R/structure.png?h=300&w=458 "2,3-Dimethyl-1,5-diphenyl-2,4-diazabicyclo[3.2.0]hept-3-ene-6-carbonitrile")
