CID 13619235

Pyrazolo[1,5-b]pyridazine-3-carboxylic acid

Structural Information

Molecular Formula
C7H5N3O2
SMILES
C1=CC2=C(C=NN2N=C1)C(=O)O
InChI
InChI=1S/C7H5N3O2/c11-7(12)5-4-9-10-6(5)2-1-3-8-10/h1-4H,(H,11,12)
InChIKey
ZYPYCOBBCUKALX-UHFFFAOYSA-N
Compound name
pyrazolo[1,5-b]pyridazine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

163.03818 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04546 129.8
[M+Na]+ 186.02740 142.9
[M+NH4]+ 181.07200 137.0
[M+K]+ 202.00134 140.0
[M-H]- 162.03090 129.2
[M+Na-2H]- 184.01285 136.0
[M]+ 163.03763 131.3
[M]- 163.03873 131.3
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