CID 592353

Methyl 4-aminopyridine-3-carboxylate

Structural Information

Molecular Formula
C7H8N2O2
SMILES
COC(=O)C1=C(C=CN=C1)N
InChI
InChI=1S/C7H8N2O2/c1-11-7(10)5-4-9-3-2-6(5)8/h2-4H,1H3,(H2,8,9)
InChIKey
OCARFFAPQGYGBP-UHFFFAOYSA-N
Compound name
methyl 4-aminopyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

421
Patents

152.05858 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.065856 129.1
[M+Na]+ 175.047798 137.5
[M-H]- 151.051304 131.4
[M+NH4]+ 170.092403 148.5
[M+K]+ 191.021738 136.4
[M+H-H2O]+ 135.055840 122.6
[M+HCOO]- 197.056781 153.1
[M+CH3COO]- 211.072431 176.5
[M+Na-2H]- 173.033246 135.7
[M]+ 152.05803142 128.8
[M]- 152.05912858 128.8
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