CID 16253

2,4,5-tribromoimidazole

Structural Information

Molecular Formula
C3HBr3N2
SMILES
C1(=C(N=C(N1)Br)Br)Br
InChI
InChI=1S/C3HBr3N2/c4-1-2(5)8-3(6)7-1/h(H,7,8)
InChIKey
JCGGPCDDFXIVQB-UHFFFAOYSA-N
Compound name
2,4,5-tribromo-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

848
Patents

301.76898 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.77626 153.3
[M+Na]+ 324.75820 146.0
[M+NH4]+ 319.80280 154.2
[M+K]+ 340.73214 154.8
[M-H]- 300.76170 154.4
[M+Na-2H]- 322.74365 154.1
[M]+ 301.76843 152.3
[M]- 301.76953 152.3
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

patents stripe