CID 15269106

5-methoxy-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid

Structural Information

Molecular Formula
C8H9NO4
SMILES
CN1C=C(C=C(C1=O)OC)C(=O)O
InChI
InChI=1S/C8H9NO4/c1-9-4-5(8(11)12)3-6(13-2)7(9)10/h3-4H,1-2H3,(H,11,12)
InChIKey
RDLWRAOPPRQBOM-UHFFFAOYSA-N
Compound name
5-methoxy-1-methyl-6-oxopyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.05316 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.06044 135.3
[M+Na]+ 206.04238 147.7
[M+NH4]+ 201.08698 141.5
[M+K]+ 222.01632 143.8
[M-H]- 182.04588 134.8
[M+Na-2H]- 204.02783 140.2
[M]+ 183.05261 136.7
[M]- 183.05371 136.7
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.