CID 19073251

2,4-dimethoxypyridine-3-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H9NO4
SMILES
COC1=C(C(=NC=C1)OC)C(=O)O
InChI
InChI=1S/C8H9NO4/c1-12-5-3-4-9-7(13-2)6(5)8(10)11/h3-4H,1-2H3,(H,10,11)
InChIKey
PFDYTDIXLXCQLK-UHFFFAOYSA-N
Compound name
2,4-dimethoxypyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

183.05316 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.060436 134.4
[M+Na]+ 206.042378 143.5
[M-H]- 182.045884 136.0
[M+NH4]+ 201.086983 152.5
[M+K]+ 222.016318 142.8
[M+H-H2O]+ 166.050420 128.1
[M+HCOO]- 228.051361 156.6
[M+CH3COO]- 242.067011 178.8
[M+Na-2H]- 204.027826 140.1
[M]+ 183.05261142 137.8
[M]- 183.05370858 137.8
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