CID 618231

15469-97-3

Structural Information

Molecular Formula
C22H18N2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=CN=C4
InChI
InChI=1S/C22H18N2/c1-4-10-19(11-5-1)22(24-17-16-23-18-24,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-18H
InChIKey
NPZDCTUDQYGYQD-UHFFFAOYSA-N
Compound name
1-tritylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

919
Patents

310.147 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.15428 174.2
[M+Na]+ 333.13622 180.2
[M-H]- 309.13972 183.6
[M+NH4]+ 328.18082 186.3
[M+K]+ 349.11016 173.3
[M+H-H2O]+ 293.14426 163.0
[M+HCOO]- 355.14520 194.6
[M+CH3COO]- 369.16085 184.6
[M+Na-2H]- 331.12167 180.4
[M]+ 310.14645 171.7
[M]- 310.14755 171.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe