CID 136209102

3-hydroxy-2-oxo-1,2-dihydropyridine-4-carbaldehyde

Structural Information

Molecular Formula
C6H5NO3
SMILES
C1=CNC(=O)C(=C1C=O)O
InChI
InChI=1S/C6H5NO3/c8-3-4-1-2-7-6(10)5(4)9/h1-3,9H,(H,7,10)
InChIKey
QBNVLUXDUVTUIG-UHFFFAOYSA-N
Compound name
3-hydroxy-2-oxo-1H-pyridine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

139.02695 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.03423 124.1
[M+Na]+ 162.01617 136.8
[M+NH4]+ 157.06077 131.0
[M+K]+ 177.99011 132.0
[M-H]- 138.01967 123.8
[M+Na-2H]- 160.00162 129.9
[M]+ 139.02640 125.5
[M]- 139.02750 125.5
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