CID 314542

14691-35-1

Structural Information

Molecular Formula

C₂₁H₁₆N₂O

SMILES

C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=CC=C3O)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O/c24-18-14-8-7-13-17(18)21-22-19(15-9-3-1-4-10-15)20(23-21)16-11-5-2-6-12-16/h1-14,24H,(H,22,23)

InChIKey

IKZDMJSZEMDIMC-UHFFFAOYSA-N

Compound name

2-(4,5-diphenyl-1H-imidazol-2-yl)phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 407
Patents: 312.12625 Da
Monoisotopic Mass: 4.7
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]+	313.13353	176.5
[M+Na]+	335.11547	194.0
[M+NH4]+	330.16007	185.1
[M+K]+	351.08941	186.2
[M-H]-	311.11897	184.2
[M+Na-2H]-	333.10092	189.3
[M]+	312.12570	181.4
[M]-	312.12680	181.4

Literature stripe

literature stripe

Patent stripe

patents stripe