CID 41974

5,5-diallyl-n,1-dicyclohexyl-2,4,6-trioxonipecotamide

Structural Information

Molecular Formula
C24H34N2O4
SMILES
C=CCC1(C(=O)C(C(=O)N(C1=O)C2CCCCC2)C(=O)NC3CCCCC3)CC=C
InChI
InChI=1S/C24H34N2O4/c1-3-15-24(16-4-2)20(27)19(21(28)25-17-11-7-5-8-12-17)22(29)26(23(24)30)18-13-9-6-10-14-18/h3-4,17-19H,1-2,5-16H2,(H,25,28)
InChIKey
CSLJSIKAKZICMD-UHFFFAOYSA-N
Compound name
N,1-dicyclohexyl-2,4,6-trioxo-5,5-bis(prop-2-enyl)piperidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

414.25186 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.25914 201.6
[M+Na]+ 437.24108 201.7
[M-H]- 413.24458 206.7
[M+NH4]+ 432.28568 211.1
[M+K]+ 453.21502 196.6
[M+H-H2O]+ 397.24912 192.1
[M+HCOO]- 459.25006 211.2
[M+CH3COO]- 473.26571 229.0
[M+Na-2H]- 435.22653 195.6
[M]+ 414.25131 191.6
[M]- 414.25241 191.6
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.