CID 11041121

3-hydroxy-4-methoxypyridine-2-carboxylic acid

Structural Information

Molecular Formula
C7H7NO4
SMILES
COC1=C(C(=NC=C1)C(=O)O)O
InChI
InChI=1S/C7H7NO4/c1-12-4-2-3-8-5(6(4)9)7(10)11/h2-3,9H,1H3,(H,10,11)
InChIKey
OBHHCPRYWZKEIM-UHFFFAOYSA-N
Compound name
3-hydroxy-4-methoxypyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

591
Patents

169.0375 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.044776 130.6
[M+Na]+ 192.026718 139.7
[M-H]- 168.030224 131.0
[M+NH4]+ 187.071323 148.6
[M+K]+ 208.000658 138.4
[M+H-H2O]+ 152.034760 124.8
[M+HCOO]- 214.035701 151.6
[M+CH3COO]- 228.051351 173.3
[M+Na-2H]- 190.012166 136.4
[M]+ 169.03695142 131.8
[M]- 169.03804858 131.8
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