CID 135419024

3-amino-2-phenyl-2h-pyrazolo[4,3-c]pyridine-4,6-diol

Structural Information

Molecular Formula
C12H10N4O2
SMILES
C1=CC=C(C=C1)N2C(=C3C(=N2)C=C(NC3=O)O)N
InChI
InChI=1S/C12H10N4O2/c13-11-10-8(6-9(17)14-12(10)18)15-16(11)7-4-2-1-3-5-7/h1-6,17H,13H2,(H,14,18)
InChIKey
QDQPFDKWYQPJRB-UHFFFAOYSA-N
Compound name
3-amino-6-hydroxy-2-phenyl-5H-pyrazolo[4,3-c]pyridin-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

8
Patents

242.08037 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.08765 151.4
[M+Na]+ 265.06959 163.4
[M-H]- 241.07309 153.9
[M+NH4]+ 260.11419 166.3
[M+K]+ 281.04353 157.0
[M+H-H2O]+ 225.07763 143.2
[M+HCOO]- 287.07857 172.5
[M+CH3COO]- 301.09422 163.7
[M+Na-2H]- 263.05504 157.6
[M]+ 242.07982 150.9
[M]- 242.08092 150.9
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.