CID 202192

Uracil, 3-cyclohexyl-1,6-dimethyl-

Structural Information

Molecular Formula
C12H18N2O2
SMILES
CC1=CC(=O)N(C(=O)N1C)C2CCCCC2
InChI
InChI=1S/C12H18N2O2/c1-9-8-11(15)14(12(16)13(9)2)10-6-4-3-5-7-10/h8,10H,3-7H2,1-2H3
InChIKey
MGWIFJQTMOFETJ-UHFFFAOYSA-N
Compound name
3-cyclohexyl-1,6-dimethylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

222.13683 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.14411 148.9
[M+Na]+ 245.12605 157.6
[M-H]- 221.12955 153.1
[M+NH4]+ 240.17065 165.0
[M+K]+ 261.09999 154.3
[M+H-H2O]+ 205.13409 140.7
[M+HCOO]- 267.13503 167.8
[M+CH3COO]- 281.15068 189.6
[M+Na-2H]- 243.11150 152.2
[M]+ 222.13628 147.1
[M]- 222.13738 147.1
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