CID 21928318

3-fluoro-6-hydroxypicolinic acid

Structural Information

Molecular Formula
C6H4FNO3
SMILES
C1=CC(=O)NC(=C1F)C(=O)O
InChI
InChI=1S/C6H4FNO3/c7-3-1-2-4(9)8-5(3)6(10)11/h1-2H,(H,8,9)(H,10,11)
InChIKey
QZYZLTZNQIKHRV-UHFFFAOYSA-N
Compound name
3-fluoro-6-oxo-1H-pyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

157.01752 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.02480 124.8
[M+Na]+ 180.00674 134.7
[M-H]- 156.01024 124.0
[M+NH4]+ 175.05134 143.2
[M+K]+ 195.98068 132.0
[M+H-H2O]+ 140.01478 118.5
[M+HCOO]- 202.01572 145.0
[M+CH3COO]- 216.03137 170.0
[M+Na-2H]- 177.99219 130.4
[M]+ 157.01697 122.3
[M]- 157.01807 122.3
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

patents stripe