CID 2050133

4-(methylamino)pyridine-2-carboxylic acid

Structural Information

Molecular Formula
C7H8N2O2
SMILES
CNC1=CC(=NC=C1)C(=O)O
InChI
InChI=1S/C7H8N2O2/c1-8-5-2-3-9-6(4-5)7(10)11/h2-4H,1H3,(H,8,9)(H,10,11)
InChIKey
DGQGIUNYNBRAKU-UHFFFAOYSA-N
Compound name
4-(methylamino)pyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

8
Patents

152.05858 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.06586 129.7
[M+Na]+ 175.04780 141.1
[M+NH4]+ 170.09240 137.0
[M+K]+ 191.02174 136.4
[M-H]- 151.05130 130.5
[M+Na-2H]- 173.03325 135.9
[M]+ 152.05803 131.2
[M]- 152.05913 131.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe