CID 135526603

10357-91-2

Structural Information

Molecular Formula
C6H5NO4
SMILES
C1=CC(=O)NC(=C1C(=O)O)O
InChI
InChI=1S/C6H5NO4/c8-4-2-1-3(6(10)11)5(9)7-4/h1-2H,(H,10,11)(H2,7,8,9)
InChIKey
IGCZQNUHGOYVJI-UHFFFAOYSA-N
Compound name
2-hydroxy-6-oxo-1H-pyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

213
Patents

155.02185 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.029126 126.1
[M+Na]+ 178.011068 135.5
[M-H]- 154.014574 125.3
[M+NH4]+ 173.055673 143.9
[M+K]+ 193.985008 132.8
[M+H-H2O]+ 138.019110 120.8
[M+HCOO]- 200.020051 146.1
[M+CH3COO]- 214.035701 167.1
[M+Na-2H]- 175.996516 131.8
[M]+ 155.02130142 124.3
[M]- 155.02239858 124.3
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