CID 67251082

1h-pyrazolo[3,4-b]pyridine-6-carboxylic acid

Structural Information

Molecular Formula
C7H5N3O2
SMILES
C1=CC(=NC2=C1C=NN2)C(=O)O
InChI
InChI=1S/C7H5N3O2/c11-7(12)5-2-1-4-3-8-10-6(4)9-5/h1-3H,(H,11,12)(H,8,9,10)
InChIKey
UHBHAVOFBLUPBB-UHFFFAOYSA-N
Compound name
1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

163.03818 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04546 130.3
[M+Na]+ 186.02740 142.9
[M+NH4]+ 181.07200 137.1
[M+K]+ 202.00134 140.2
[M-H]- 162.03090 129.2
[M+Na-2H]- 184.01285 135.9
[M]+ 163.03763 131.5
[M]- 163.03873 131.5
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

No patent data available for this compound.