CID 135401879

3-amino-1h-pyrazolo[4,3-c]pyridine-4,6-diol

Structural Information

Molecular Formula
C6H6N4O2
SMILES
C1=C2C(=C(NC1=O)O)C(=NN2)N
InChI
InChI=1S/C6H6N4O2/c7-5-4-2(9-10-5)1-3(11)8-6(4)12/h1H,(H3,7,9,10)(H2,8,11,12)
InChIKey
RWHCQACUVWSYNC-UHFFFAOYSA-N
Compound name
3-amino-4-hydroxy-1,5-dihydropyrazolo[4,3-c]pyridin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

6
Patents

166.04907 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.05635 130.2
[M+Na]+ 189.03829 141.8
[M+NH4]+ 184.08289 136.2
[M+K]+ 205.01223 140.0
[M-H]- 165.04179 128.9
[M+Na-2H]- 187.02374 134.3
[M]+ 166.04852 131.0
[M]- 166.04962 131.0
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