CID 2734431

2-amino-4-methylpyridine-3-carboxylic 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

115
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 129.3
[M+Na]+ 175.04780 138.2
[M-H]- 151.05130 130.6
[M+NH4]+ 170.09240 148.3
[M+K]+ 191.02174 136.3
[M+H-H2O]+ 135.05584 123.4
[M+HCOO]- 197.05678 151.8
[M+CH3COO]- 211.07243 175.9
[M+Na-2H]- 173.03325 134.7
[M]+ 152.05803 127.7
[M]- 152.05913 127.7
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

patents stripe