CID 4180439

4,5-diphenyl-1-tritylimidazole

Structural Information

Molecular Formula
C34H26N2
SMILES
C1=CC=C(C=C1)C2=C(N(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C34H26N2/c1-6-16-27(17-7-1)32-33(28-18-8-2-9-19-28)36(26-35-32)34(29-20-10-3-11-21-29,30-22-12-4-13-23-30)31-24-14-5-15-25-31/h1-26H
InChIKey
LGEQKBQDFVOESR-UHFFFAOYSA-N
Compound name
4,5-diphenyl-1-tritylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

462.2096 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 463.21688 216.6
[M+Na]+ 485.19882 221.0
[M-H]- 461.20232 230.7
[M+NH4]+ 480.24342 221.1
[M+K]+ 501.17276 210.8
[M+H-H2O]+ 445.20686 201.9
[M+HCOO]- 507.20780 234.0
[M+CH3COO]- 521.22345 223.3
[M+Na-2H]- 483.18427 218.7
[M]+ 462.20905 212.4
[M]- 462.21015 212.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe