CID 16227843

2,4-dioxo-1-propyl-1h,2h,3h,4h-pyrido[2,3-d]pyrimidine-6-carboxylic acid

Structural Information

Molecular Formula
C11H11N3O4
SMILES
CCCN1C2=C(C=C(C=N2)C(=O)O)C(=O)NC1=O
InChI
InChI=1S/C11H11N3O4/c1-2-3-14-8-7(9(15)13-11(14)18)4-6(5-12-8)10(16)17/h4-5H,2-3H2,1H3,(H,16,17)(H,13,15,18)
InChIKey
ZUWLKGSAWHMFJK-UHFFFAOYSA-N
Compound name
2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.07495 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.082226 152.6
[M+Na]+ 272.064168 163.6
[M-H]- 248.067674 151.4
[M+NH4]+ 267.108773 165.8
[M+K]+ 288.038108 159.0
[M+H-H2O]+ 232.072210 144.9
[M+HCOO]- 294.073151 169.5
[M+CH3COO]- 308.088801 190.0
[M+Na-2H]- 270.049616 158.0
[M]+ 249.07440142 154.4
[M]- 249.07549858 154.4
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

No patent data available for this compound.