CID 137661

1,2-diphenylbenzimidazole

Structural Information

Molecular Formula
C19H14N2
SMILES
C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2C4=CC=CC=C4
InChI
InChI=1S/C19H14N2/c1-3-9-15(10-4-1)19-20-17-13-7-8-14-18(17)21(19)16-11-5-2-6-12-16/h1-14H
InChIKey
ZLGVZKQXZYQJSM-UHFFFAOYSA-N
Compound name
1,2-diphenylbenzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3377
Patents

270.1157 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.12298 162.0
[M+Na]+ 293.10492 172.0
[M-H]- 269.10842 170.5
[M+NH4]+ 288.14952 177.9
[M+K]+ 309.07886 164.9
[M+H-H2O]+ 253.11296 151.9
[M+HCOO]- 315.11390 185.1
[M+CH3COO]- 329.12955 174.5
[M+Na-2H]- 291.09037 169.2
[M]+ 270.11515 162.7
[M]- 270.11625 162.7
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