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]+ 335.23293 184.4
[M+Na]+ 357.21487 185.7
[M-H]- 333.21837 188.9
[M+NH4]+ 352.25947 194.4
[M+K]+ 373.18881 182.1
[M+H-H2O]+ 317.22291 174.1
[M+HCOO]- 379.22385 192.6
[M+CH3COO]- 393.23950 212.5
[M+Na-2H]- 355.20032 178.5
[M]+ 334.22510 174.2
[M]- 334.22620 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.