CID 20217044

6-amino-1-(cyclohexylmethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

Structural Information

Molecular Formula
C11H17N3O2
SMILES
C1CCC(CC1)CN2C(=CC(=O)NC2=O)N
InChI
InChI=1S/C11H17N3O2/c12-9-6-10(15)13-11(16)14(9)7-8-4-2-1-3-5-8/h6,8H,1-5,7,12H2,(H,13,15,16)
InChIKey
VAQQYUKMYBFRGG-UHFFFAOYSA-N
Compound name
6-amino-1-(cyclohexylmethyl)pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

223.13208 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.13936 149.9
[M+Na]+ 246.12130 161.3
[M+NH4]+ 241.16590 156.4
[M+K]+ 262.09524 155.7
[M-H]- 222.12480 152.0
[M+Na-2H]- 244.10675 155.4
[M]+ 223.13153 151.7
[M]- 223.13263 151.7
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