CID 8027203

Ethyl 6-hydroxypyridine-2-carboxylate

Structural Information

Molecular Formula
C8H9NO3
SMILES
CCOC(=O)C1=CC=CC(=O)N1
InChI
InChI=1S/C8H9NO3/c1-2-12-8(11)6-4-3-5-7(10)9-6/h3-5H,2H2,1H3,(H,9,10)
InChIKey
BHTPNYOMVLJREU-UHFFFAOYSA-N
Compound name
ethyl 6-oxo-1H-pyridine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

122
Patents

167.05824 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.065516 131.5
[M+Na]+ 190.047458 140.1
[M-H]- 166.050964 132.8
[M+NH4]+ 185.092063 150.1
[M+K]+ 206.021398 138.3
[M+H-H2O]+ 150.055500 125.3
[M+HCOO]- 212.056441 153.7
[M+CH3COO]- 226.072091 174.0
[M+Na-2H]- 188.032906 137.9
[M]+ 167.05769142 132.2
[M]- 167.05878858 132.2
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