CID 5274879

Chembl3892341

Structural Information

Molecular Formula
C12H9FN2O2
SMILES
C1=CC(=C(N=C1)C(=O)NC2=CC=C(C=C2)F)O
InChI
InChI=1S/C12H9FN2O2/c13-8-3-5-9(6-4-8)15-12(17)11-10(16)2-1-7-14-11/h1-7,16H,(H,15,17)
InChIKey
XCZBGOGZMPZPRK-UHFFFAOYSA-N
Compound name
N-(4-fluorophenyl)-3-hydroxypyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

232.0648 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.072076 147.9
[M+Na]+ 255.054018 156.0
[M-H]- 231.057524 151.2
[M+NH4]+ 250.098623 163.3
[M+K]+ 271.027958 151.9
[M+H-H2O]+ 215.062060 139.1
[M+HCOO]- 277.063001 169.8
[M+CH3COO]- 291.078651 189.5
[M+Na-2H]- 253.039466 153.8
[M]+ 232.06425142 145.4
[M]- 232.06534858 145.4
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

No patent data available for this compound.