CID 98820

2-benzhydryl-1h-benzoimidazole

Structural Information

Molecular Formula
C20H16N2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=NC4=CC=CC=C4N3
InChI
InChI=1S/C20H16N2/c1-3-9-15(10-4-1)19(16-11-5-2-6-12-16)20-21-17-13-7-8-14-18(17)22-20/h1-14,19H,(H,21,22)
InChIKey
LJAKIPHFUHHTOQ-UHFFFAOYSA-N
Compound name
2-benzhydryl-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

109
Patents

284.13135 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13863 165.8
[M+Na]+ 307.12057 173.7
[M-H]- 283.12407 172.6
[M+NH4]+ 302.16517 180.1
[M+K]+ 323.09451 166.0
[M+H-H2O]+ 267.12861 155.9
[M+HCOO]- 329.12955 186.2
[M+CH3COO]- 343.14520 176.8
[M+Na-2H]- 305.10602 171.9
[M]+ 284.13080 164.1
[M]- 284.13190 164.1
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