CID 46835269

8-bromo-6-chloroimidazo[1,2-b]pyridazine

Structural Information

Molecular Formula
C6H3BrClN3
SMILES
C1=CN2C(=N1)C(=CC(=N2)Cl)Br
InChI
InChI=1S/C6H3BrClN3/c7-4-3-5(8)10-11-2-1-9-6(4)11/h1-3H
InChIKey
LZEJQXOCRMRVNP-UHFFFAOYSA-N
Compound name
8-bromo-6-chloroimidazo[1,2-b]pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

360
Patents

230.91989 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.92717 132.7
[M+Na]+ 253.90911 149.7
[M-H]- 229.91261 137.1
[M+NH4]+ 248.95371 154.8
[M+K]+ 269.88305 137.3
[M+H-H2O]+ 213.91715 132.6
[M+HCOO]- 275.91809 149.7
[M+CH3COO]- 289.93374 149.3
[M+Na-2H]- 251.89456 143.2
[M]+ 230.91934 155.1
[M]- 230.92044 155.1
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

patents stripe