CID 84048702

3-fluoro-5-hydroxypyridine-4-carboxylic acid

Structural Information

Molecular Formula
C6H4FNO3
SMILES
C1=C(C(=C(C=N1)F)C(=O)O)O
InChI
InChI=1S/C6H4FNO3/c7-3-1-8-2-4(9)5(3)6(10)11/h1-2,9H,(H,10,11)
InChIKey
VTBCAJWHLYVTTR-UHFFFAOYSA-N
Compound name
3-fluoro-5-hydroxypyridine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.01752 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.02480 125.7
[M+Na]+ 180.00674 135.4
[M-H]- 156.01024 124.9
[M+NH4]+ 175.05134 144.2
[M+K]+ 195.98068 133.3
[M+H-H2O]+ 140.01478 119.3
[M+HCOO]- 202.01572 145.8
[M+CH3COO]- 216.03137 170.8
[M+Na-2H]- 177.99219 131.4
[M]+ 157.01697 123.9
[M]- 157.01807 123.9
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.