CID 2779714

Ethyl 6-chloroimidazo[1,2-b]pyridazine-2-carboxylate

Structural Information

Molecular Formula
C9H8ClN3O2
SMILES
CCOC(=O)C1=CN2C(=N1)C=CC(=N2)Cl
InChI
InChI=1S/C9H8ClN3O2/c1-2-15-9(14)6-5-13-8(11-6)4-3-7(10)12-13/h3-5H,2H2,1H3
InChIKey
AZEPEWATPYRPBM-UHFFFAOYSA-N
Compound name
ethyl 6-chloroimidazo[1,2-b]pyridazine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

134
Patents

225.0305 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.03778 143.6
[M+Na]+ 248.01972 158.0
[M+NH4]+ 243.06432 151.0
[M+K]+ 263.99366 153.6
[M-H]- 224.02322 143.5
[M+Na-2H]- 246.00517 149.7
[M]+ 225.02995 145.8
[M]- 225.03105 145.8
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