CID 3044072

56714-17-1

Structural Information

Molecular Formula
C23H27NO3
SMILES
C=CCC1(C(=O)C(C(=O)N(C1=O)C2CCCCC2)C3=CC=CC=C3)CC=C
InChI
InChI=1S/C23H27NO3/c1-3-15-23(16-4-2)20(25)19(17-11-7-5-8-12-17)21(26)24(22(23)27)18-13-9-6-10-14-18/h3-5,7-8,11-12,18-19H,1-2,6,9-10,13-16H2
InChIKey
DDWZWIOZOLOARS-UHFFFAOYSA-N
Compound name
1-cyclohexyl-5-phenyl-3,3-bis(prop-2-enyl)piperidine-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.1991 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.20638 188.9
[M+Na]+ 388.18832 193.4
[M-H]- 364.19182 195.6
[M+NH4]+ 383.23292 201.3
[M+K]+ 404.16226 187.2
[M+H-H2O]+ 348.19636 179.2
[M+HCOO]- 410.19730 203.0
[M+CH3COO]- 424.21295 217.6
[M+Na-2H]- 386.17377 186.4
[M]+ 365.19855 183.3
[M]- 365.19965 183.3
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.