CID 2762507

183741-91-5

Structural Information

Molecular Formula
C7H8N2O3
SMILES
COC1=NC=C(C(=C1)C(=O)O)N
InChI
InChI=1S/C7H8N2O3/c1-12-6-2-4(7(10)11)5(8)3-9-6/h2-3H,8H2,1H3,(H,10,11)
InChIKey
BFYPMZJYCXUXFW-UHFFFAOYSA-N
Compound name
5-amino-2-methoxypyridine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

168.0535 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.06078 132.1
[M+Na]+ 191.04272 140.8
[M-H]- 167.04622 133.4
[M+NH4]+ 186.08732 150.3
[M+K]+ 207.01666 139.4
[M+H-H2O]+ 151.05076 125.8
[M+HCOO]- 213.05170 154.8
[M+CH3COO]- 227.06735 178.1
[M+Na-2H]- 189.02817 137.5
[M]+ 168.05295 131.9
[M]- 168.05405 131.9
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