CID 131600554

5-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile

Structural Information

Molecular Formula
C8H5N3O
SMILES
C1=CN2C(=CC1=O)C(=CN2)C#N
InChI
InChI=1S/C8H5N3O/c9-4-6-5-10-11-2-1-7(12)3-8(6)11/h1-3,5,10H
InChIKey
FRUMSDLVLZWMTL-UHFFFAOYSA-N
Compound name
5-oxo-1H-pyrazolo[1,5-a]pyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.04326 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.05054 131.8
[M+Na]+ 182.03248 145.1
[M-H]- 158.03598 132.2
[M+NH4]+ 177.07708 150.1
[M+K]+ 198.00642 139.8
[M+H-H2O]+ 142.04052 118.2
[M+HCOO]- 204.04146 151.0
[M+CH3COO]- 218.05711 144.3
[M+Na-2H]- 180.01793 139.0
[M]+ 159.04271 127.4
[M]- 159.04381 127.4
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.