CID 120782

743-40-8

Structural Information

Molecular Formula
C19H30N2O3
SMILES
CC(C)C1C(=O)N(C(=O)N(C1=O)C2CCCCC2)C3CCCCC3
InChI
InChI=1S/C19H30N2O3/c1-13(2)16-17(22)20(14-9-5-3-6-10-14)19(24)21(18(16)23)15-11-7-4-8-12-15/h13-16H,3-12H2,1-2H3
InChIKey
UMPHDYUBMKHEQZ-UHFFFAOYSA-N
Compound name
1,3-dicyclohexyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

334.22565 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.232926 184.4
[M+Na]+ 357.214868 185.7
[M-H]- 333.218374 188.9
[M+NH4]+ 352.259473 194.4
[M+K]+ 373.188808 182.1
[M+H-H2O]+ 317.222910 174.1
[M+HCOO]- 379.223851 192.6
[M+CH3COO]- 393.239501 212.5
[M+Na-2H]- 355.200316 178.5
[M]+ 334.22510142 174.2
[M]- 334.22619858 174.2
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.