CID 136195371

(2-bromophenyl)-[2-(4-hydroxyphenyl)benzimidazol-1-yl]methanone

Structural Information

Molecular Formula
C20H13BrN2O2
SMILES
C1=CC=C(C(=C1)C(=O)N2C3=CC=CC=C3N=C2C4=CC=C(C=C4)O)Br
InChI
InChI=1S/C20H13BrN2O2/c21-16-6-2-1-5-15(16)20(25)23-18-8-4-3-7-17(18)22-19(23)13-9-11-14(24)12-10-13/h1-12,24H
InChIKey
PCNJPSRUBUXNGY-UHFFFAOYSA-N
Compound name
(2-bromophenyl)-[2-(4-hydroxyphenyl)benzimidazol-1-yl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

392.01605 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.02333 184.9
[M+Na]+ 415.00527 197.4
[M-H]- 391.00877 195.1
[M+NH4]+ 410.04987 199.5
[M+K]+ 430.97921 184.4
[M+H-H2O]+ 375.01331 182.6
[M+HCOO]- 437.01425 203.4
[M+CH3COO]- 451.02990 197.5
[M+Na-2H]- 412.99072 189.4
[M]+ 392.01550 204.9
[M]- 392.01660 204.9
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

No patent data available for this compound.