CID 12936

743-43-1

Structural Information

Molecular Formula
C19H28N2O3
SMILES
C=CCC1C(=O)N(C(=O)N(C1=O)C2CCCCC2)C3CCCCC3
InChI
InChI=1S/C19H28N2O3/c1-2-9-16-17(22)20(14-10-5-3-6-11-14)19(24)21(18(16)23)15-12-7-4-8-13-15/h2,14-16H,1,3-13H2
InChIKey
VTHNOHNTKWFDGT-UHFFFAOYSA-N
Compound name
1,3-dicyclohexyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.21 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.21728 184.1
[M+Na]+ 355.19922 193.7
[M+NH4]+ 350.24382 190.0
[M+K]+ 371.17316 186.9
[M-H]- 331.20272 187.2
[M+Na-2H]- 353.18467 186.7
[M]+ 332.20945 185.8
[M]- 332.21055 185.8
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.