CID 84027546

Imidazo[1,2-b]pyridazine-3-sulfonyl chloride

Structural Information

Molecular Formula
C6H4ClN3O2S
SMILES
C1=CC2=NC=C(N2N=C1)S(=O)(=O)Cl
InChI
InChI=1S/C6H4ClN3O2S/c7-13(11,12)6-4-8-5-2-1-3-9-10(5)6/h1-4H
InChIKey
KAXGTARSGVEOPB-UHFFFAOYSA-N
Compound name
imidazo[1,2-b]pyridazine-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

216.97127 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.978546 140.0
[M+Na]+ 239.960488 154.0
[M-H]- 215.963994 142.2
[M+NH4]+ 235.005093 159.2
[M+K]+ 255.934428 149.7
[M+H-H2O]+ 199.968530 134.2
[M+HCOO]- 261.969471 153.2
[M+CH3COO]- 275.985121 154.1
[M+Na-2H]- 237.945936 147.2
[M]+ 216.97072142 146.7
[M]- 216.97181858 146.7
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