CID 7204881

2,4-dibromo-1-trityl-1h-imidazole

Structural Information

Molecular Formula
C22H16Br2N2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4Br)Br
InChI
InChI=1S/C22H16Br2N2/c23-20-16-26(21(24)25-20)22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H
InChIKey
XXGYCEHPOQAPKF-UHFFFAOYSA-N
Compound name
2,4-dibromo-1-tritylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

465.96802 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 466.97530 188.4
[M+Na]+ 488.95724 197.2
[M-H]- 464.96074 199.9
[M+NH4]+ 484.00184 200.8
[M+K]+ 504.93118 182.2
[M+H-H2O]+ 448.96528 195.4
[M+HCOO]- 510.96622 202.0
[M+CH3COO]- 524.98187 199.5
[M+Na-2H]- 486.94269 193.1
[M]+ 465.96747 221.2
[M]- 465.96857 221.2
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.