CID 139596144

Hydroxy-lenacil

Structural Information

Molecular Formula
C13H18N2O3
SMILES
C1CCC(CC1)N2C(=O)C3=C(CCC3O)NC2=O
InChI
InChI=1S/C13H18N2O3/c16-10-7-6-9-11(10)12(17)15(13(18)14-9)8-4-2-1-3-5-8/h8,10,16H,1-7H2,(H,14,18)
InChIKey
MUPNWQUPWMRNGB-UHFFFAOYSA-N
Compound name
3-cyclohexyl-5-hydroxy-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

250.13174 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.13902 156.6
[M+Na]+ 273.12096 167.6
[M+NH4]+ 268.16556 163.5
[M+K]+ 289.09490 164.0
[M-H]- 249.12446 157.7
[M+Na-2H]- 271.10641 159.8
[M]+ 250.13119 158.1
[M]- 250.13229 158.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.