CID 212854

Uracil, 1-allyl-3-methyl-5-propyl-

Structural Information

Molecular Formula
C11H16N2O2
SMILES
CCCC1=CN(C(=O)N(C1=O)C)CC=C
InChI
InChI=1S/C11H16N2O2/c1-4-6-9-8-13(7-5-2)11(15)12(3)10(9)14/h5,8H,2,4,6-7H2,1,3H3
InChIKey
WKAXKWZDVWEIOQ-UHFFFAOYSA-N
Compound name
3-methyl-1-prop-2-enyl-5-propylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.12119 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 146.3
[M+Na]+ 231.11041 160.0
[M+NH4]+ 226.15501 152.5
[M+K]+ 247.08435 153.5
[M-H]- 207.11391 146.3
[M+Na-2H]- 229.09586 151.3
[M]+ 208.12064 148.1
[M]- 208.12174 148.1
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

No patent data available for this compound.