CID 3063962

Brn 0298426

Structural Information

Molecular Formula
C18H27N3O2
SMILES
CC1=C(C(=O)N(C(=O)N1C)C2CCCCC2)N(CC=C)CC=C
InChI
InChI=1S/C18H27N3O2/c1-5-12-20(13-6-2)16-14(3)19(4)18(23)21(17(16)22)15-10-8-7-9-11-15/h5-6,15H,1-2,7-13H2,3-4H3
InChIKey
VKCBSYASCAEHOF-UHFFFAOYSA-N
Compound name
5-[bis(prop-2-enyl)amino]-3-cyclohexyl-1,6-dimethylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.21033 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.21761 177.5
[M+Na]+ 340.19955 189.3
[M+NH4]+ 335.24415 183.0
[M+K]+ 356.17349 182.4
[M-H]- 316.20305 180.0
[M+Na-2H]- 338.18500 182.0
[M]+ 317.20978 179.6
[M]- 317.21088 179.6
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.