CID 23094070

2620-76-0

Structural Information

Molecular Formula

C₁₉H₁₃BrN₂

SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H13BrN2/c20-15-12-10-14(11-13-15)19-21-17-8-4-5-9-18(17)22(19)16-6-2-1-3-7-16/h1-13H

InChIKey

DXRLALXPCIOIDK-UHFFFAOYSA-N

Compound name

2-(4-bromophenyl)-1-phenylbenzimidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 804
Patents: 348.0262 Da
Monoisotopic Mass: 5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	349.03348	174.4
[M+Na]+	371.01542	183.2
[M+NH4]+	366.06002	180.6
[M+K]+	386.98936	180.6
[M-H]-	347.01892	179.6
[M+Na-2H]-	369.00087	182.8
[M]+	348.02565	176.4
[M]-	348.02675	176.4

Literature stripe

literature stripe

Patent stripe

patents stripe