CID 68750740

Imidazo[1,2-b]pyridazin-8(5h)-one

Structural Information

Molecular Formula
C6H5N3O
SMILES
C1=CNN2C=CN=C2C1=O
InChI
InChI=1S/C6H5N3O/c10-5-1-2-8-9-4-3-7-6(5)9/h1-4,8H
InChIKey
JCSVOZPPYLLOSV-UHFFFAOYSA-N
Compound name
5H-imidazo[1,2-b]pyridazin-8-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

135.04326 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.050536 121.6
[M+Na]+ 158.032478 133.7
[M-H]- 134.035984 121.8
[M+NH4]+ 153.077083 141.9
[M+K]+ 174.006418 130.3
[M+H-H2O]+ 118.040520 114.6
[M+HCOO]- 180.041461 144.3
[M+CH3COO]- 194.057111 136.2
[M+Na-2H]- 156.017926 131.7
[M]+ 135.04271142 122.3
[M]- 135.04380858 122.3
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