CID 14282694

2,3-dimethyl 4-aminopyridine-2,3-dicarboxylate

Structural Information

Molecular Formula
C9H10N2O4
SMILES
COC(=O)C1=C(C=CN=C1C(=O)OC)N
InChI
InChI=1S/C9H10N2O4/c1-14-8(12)6-5(10)3-4-11-7(6)9(13)15-2/h3-4H,1-2H3,(H2,10,11)
InChIKey
VOGZIFYWGKSLJR-UHFFFAOYSA-N
Compound name
dimethyl 4-aminopyridine-2,3-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

210.06406 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.07134 142.5
[M+Na]+ 233.05328 150.9
[M-H]- 209.05678 145.1
[M+NH4]+ 228.09788 159.7
[M+K]+ 249.02722 150.5
[M+H-H2O]+ 193.06132 135.6
[M+HCOO]- 255.06226 165.6
[M+CH3COO]- 269.07791 187.5
[M+Na-2H]- 231.03873 146.3
[M]+ 210.06351 144.9
[M]- 210.06461 144.9
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