SpectraBase Spectrum ID |
67WCT37toZb |
Name |
3,8-Dibenzyl-4,9-dimethyl-2,3,7tetraaza-tetracyclo[7.2.1.0(4,11).0(6,10)]dodeca-1,6-diene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
370.215746853 u |
Formula |
C24H26N4 |
InChI |
InChI=1S/C24H26N4/c1-23-13-19-22-21(23)20(25-27(23)15-17-9-5-3-6-10-17)14-24(22,2)28(26-19)16-18-11-7-4-8-12-18/h3-12,21-22H,13-16H2,1-2H3 |
InChIKey |
OGIYWBZCVXTNGI-UHFFFAOYSA-N |
Molecular Weight |
370.500 g/mol |
SMILES |
C12(C3C4C(C)(CC3=NN1CC1=CC=CC=C1)N(N=C4C2)CC1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932035 |