CID 108214

5-acetylamino-6-formylamino-3-methyluracil

Structural Information

Molecular Formula
C8H10N4O4
SMILES
CC(=O)NC1=C(NC(=O)N(C1=O)C)NC=O
InChI
InChI=1S/C8H10N4O4/c1-4(14)10-5-6(9-3-13)11-8(16)12(2)7(5)15/h3H,1-2H3,(H,9,13)(H,10,14)(H,11,16)
InChIKey
RDZNZFGKEVDNPK-UHFFFAOYSA-N
Compound name
N-(6-formamido-3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

60
References

216
Patents

226.0702 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.07748 145.0
[M+Na]+ 249.05942 155.0
[M-H]- 225.06292 146.0
[M+NH4]+ 244.10402 159.7
[M+K]+ 265.03336 152.2
[M+H-H2O]+ 209.06746 137.6
[M+HCOO]- 271.06840 168.3
[M+CH3COO]- 285.08405 191.8
[M+Na-2H]- 247.04487 149.9
[M]+ 226.06965 145.9
[M]- 226.07075 145.9
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

No patent data available for this compound.