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]+ 160.050536 131.8
[M+Na]+ 182.032478 145.1
[M-H]- 158.035984 132.2
[M+NH4]+ 177.077083 150.1
[M+K]+ 198.006418 139.8
[M+H-H2O]+ 142.040520 118.2
[M+HCOO]- 204.041461 151.0
[M+CH3COO]- 218.057111 144.3
[M+Na-2H]- 180.017926 139.0
[M]+ 159.04271142 127.4
[M]- 159.04380858 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.