CID 2734431

2-amino-4-methylnicotinic acid

Structural Information

Molecular Formula
C7H8N2O2
SMILES
CC1=C(C(=NC=C1)N)C(=O)O
InChI
InChI=1S/C7H8N2O2/c1-4-2-3-9-6(8)5(4)7(10)11/h2-3H,1H3,(H2,8,9)(H,10,11)
InChIKey
VLGIIWGQCIFWPV-UHFFFAOYSA-N
Compound name
2-amino-4-methylpyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

112
Patents

152.05858 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.06586 129.6
[M+Na]+ 175.04780 141.1
[M+NH4]+ 170.09240 136.8
[M+K]+ 191.02174 136.9
[M-H]- 151.05130 130.4
[M+Na-2H]- 173.03325 135.2
[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

No literature data available for this compound.

Patent stripe

patents stripe