CID 45050883

2-(4-bromophenyl)-1-(4-methylphenyl)-4,5-diphenyl-1h-imidazole

Structural Information

Molecular Formula
C28H21BrN2
SMILES
CC1=CC=C(C=C1)N2C(=C(N=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C28H21BrN2/c1-20-12-18-25(19-13-20)31-27(22-10-6-3-7-11-22)26(21-8-4-2-5-9-21)30-28(31)23-14-16-24(29)17-15-23/h2-19H,1H3
InChIKey
YUFGWFKZUVKSEG-UHFFFAOYSA-N
Compound name
2-(4-bromophenyl)-1-(4-methylphenyl)-4,5-diphenylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

464.0888 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 465.09608 210.7
[M+Na]+ 487.07802 221.2
[M-H]- 463.08152 225.7
[M+NH4]+ 482.12262 221.3
[M+K]+ 503.05196 206.6
[M+H-H2O]+ 447.08606 206.0
[M+HCOO]- 509.08700 229.2
[M+CH3COO]- 523.10265 221.4
[M+Na-2H]- 485.06347 211.6
[M]+ 464.08825 228.1
[M]- 464.08935 228.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.