CID 3061489

2,6-piperidinedione, 4-(4-methoxyphenyl)-1-(2-(4-phenyl-1-piperazinyl)ethyl)-

Structural Information

Molecular Formula
C24H29N3O3
SMILES
COC1=CC=C(C=C1)C2CC(=O)N(C(=O)C2)CCN3CCN(CC3)C4=CC=CC=C4
InChI
InChI=1S/C24H29N3O3/c1-30-22-9-7-19(8-10-22)20-17-23(28)27(24(29)18-20)16-13-25-11-14-26(15-12-25)21-5-3-2-4-6-21/h2-10,20H,11-18H2,1H3
InChIKey
DUHFSHFKGAFWBH-UHFFFAOYSA-N
Compound name
4-(4-methoxyphenyl)-1-[2-(4-phenylpiperazin-1-yl)ethyl]piperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

407.2209 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 408.22818 203.5
[M+Na]+ 430.21012 206.5
[M-H]- 406.21362 210.0
[M+NH4]+ 425.25472 208.5
[M+K]+ 446.18406 200.2
[M+H-H2O]+ 390.21816 189.4
[M+HCOO]- 452.21910 214.7
[M+CH3COO]- 466.23475 209.4
[M+Na-2H]- 428.19557 201.0
[M]+ 407.22035 197.8
[M]- 407.22145 197.8
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.