CID 13268346

90254-45-8

Structural Information

Molecular Formula
C9H10N4O2
SMILES
CN1C2=NC=CC(=C2C(=O)N(C1=O)C)N
InChI
InChI=1S/C9H10N4O2/c1-12-7-6(5(10)3-4-11-7)8(14)13(2)9(12)15/h3-4H,1-2H3,(H2,10,11)
InChIKey
XRUYGLAFPMXYLJ-UHFFFAOYSA-N
Compound name
5-amino-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

206.08037 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.08765 143.5
[M+Na]+ 229.06959 156.7
[M-H]- 205.07309 145.2
[M+NH4]+ 224.11419 160.0
[M+K]+ 245.04353 152.7
[M+H-H2O]+ 189.07763 135.8
[M+HCOO]- 251.07857 165.0
[M+CH3COO]- 265.09422 189.9
[M+Na-2H]- 227.05504 150.5
[M]+ 206.07982 145.4
[M]- 206.08092 145.4
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

patents stripe