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

8
Patents

210.06406 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.071336 142.5
[M+Na]+ 233.053278 150.9
[M-H]- 209.056784 145.1
[M+NH4]+ 228.097883 159.7
[M+K]+ 249.027218 150.5
[M+H-H2O]+ 193.061320 135.6
[M+HCOO]- 255.062261 165.6
[M+CH3COO]- 269.077911 187.5
[M+Na-2H]- 231.038726 146.3
[M]+ 210.06351142 144.9
[M]- 210.06460858 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