CID 88299

5-acetylamino-6-amino-3-methyluracil

Structural Information

Molecular Formula
C7H10N4O3
SMILES
CC(=O)NC1=C(NC(=O)N(C1=O)C)N
InChI
InChI=1S/C7H10N4O3/c1-3(12)9-4-5(8)10-7(14)11(2)6(4)13/h8H2,1-2H3,(H,9,12)(H,10,14)
InChIKey
POQOTWQIYYNXAT-UHFFFAOYSA-N
Compound name
N-(6-amino-3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

19
References

108
Patents

198.07529 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.08257 140.1
[M+Na]+ 221.06451 150.4
[M-H]- 197.06801 140.7
[M+NH4]+ 216.10911 155.9
[M+K]+ 237.03845 147.6
[M+H-H2O]+ 181.07255 133.1
[M+HCOO]- 243.07349 162.7
[M+CH3COO]- 257.08914 186.7
[M+Na-2H]- 219.04996 144.2
[M]+ 198.07474 138.9
[M]- 198.07584 138.9
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.