CID 210400

N-(4-(4-(o-chlorophenyl)-1-piperazinyl)butyl)-1,1-cyclopentanediacetimide hydrochloride

Structural Information

Molecular Formula
C23H32ClN3O2
SMILES
C1CCC2(C1)CC(=O)N(C(=O)C2)CCCCN3CCN(CC3)C4=CC=CC=C4Cl
InChI
InChI=1S/C23H32ClN3O2/c24-19-7-1-2-8-20(19)26-15-13-25(14-16-26)11-5-6-12-27-21(28)17-23(18-22(27)29)9-3-4-10-23/h1-2,7-8H,3-6,9-18H2
InChIKey
PXIFALFYCJJOLC-UHFFFAOYSA-N
Compound name
8-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]-8-azaspiro[4.5]decane-7,9-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

417.2183 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 418.22558 203.9
[M+Na]+ 440.20752 215.3
[M+NH4]+ 435.25212 212.1
[M+K]+ 456.18146 206.4
[M-H]- 416.21102 208.5
[M+Na-2H]- 438.19297 209.8
[M]+ 417.21775 207.0
[M]- 417.21885 207.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.