CID 3076054

129750-91-0

Structural Information

Molecular Formula
C24H37N3O6
SMILES
CC(C1C(=O)N(C(=O)N(C1=O)C2CCCCC2)C3CCCCC3)C(=O)OCN4CCOCC4
InChI
InChI=1S/C24H37N3O6/c1-17(23(30)33-16-25-12-14-32-15-13-25)20-21(28)26(18-8-4-2-5-9-18)24(31)27(22(20)29)19-10-6-3-7-11-19/h17-20H,2-16H2,1H3
InChIKey
YVHRNTICSJDWJI-UHFFFAOYSA-N
Compound name
morpholin-4-ylmethyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

463.26825 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 464.27553 212.6
[M+Na]+ 486.25747 219.0
[M+NH4]+ 481.30207 215.5
[M+K]+ 502.23141 215.5
[M-H]- 462.26097 216.2
[M+Na-2H]- 484.24292 212.6
[M]+ 463.26770 213.7
[M]- 463.26880 213.7
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.