CID 1526966

638138-07-5

Structural Information

Molecular Formula
C8H12N2O3
SMILES
CC(C)CN1C(=CC(=O)NC1=O)O
InChI
InChI=1S/C8H12N2O3/c1-5(2)4-10-7(12)3-6(11)9-8(10)13/h3,5,12H,4H2,1-2H3,(H,9,11,13)
InChIKey
OKEHPSURMGPEGE-UHFFFAOYSA-N
Compound name
6-hydroxy-1-(2-methylpropyl)pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

184.0848 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.09208 136.6
[M+Na]+ 207.07402 146.6
[M-H]- 183.07752 135.8
[M+NH4]+ 202.11862 153.0
[M+K]+ 223.04796 143.7
[M+H-H2O]+ 167.08206 130.3
[M+HCOO]- 229.08300 155.9
[M+CH3COO]- 243.09865 177.6
[M+Na-2H]- 205.05947 141.0
[M]+ 184.08425 136.9
[M]- 184.08535 136.9
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