CID 13325

Brn 0694287

Structural Information

Molecular Formula
C18H28N2O3
SMILES
CCC1C(=O)N(C(=O)N(C1=O)C2CCCCC2)C3CCCCC3
InChI
InChI=1S/C18H28N2O3/c1-2-15-16(21)19(13-9-5-3-6-10-13)18(23)20(17(15)22)14-11-7-4-8-12-14/h13-15H,2-12H2,1H3
InChIKey
YTKIPBSQWDAMQR-UHFFFAOYSA-N
Compound name
1,3-dicyclohexyl-5-ethyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.21 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.21728 180.8
[M+Na]+ 343.19922 190.6
[M+NH4]+ 338.24382 187.2
[M+K]+ 359.17316 184.1
[M-H]- 319.20272 184.2
[M+Na-2H]- 341.18467 183.7
[M]+ 320.20945 182.7
[M]- 320.21055 182.7
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.