CID 110773

6103-61-3

Structural Information

Molecular Formula
C15H19ClN2O
SMILES
C1CCN(CC1)C2CCN(C2=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C15H19ClN2O/c16-12-4-6-13(7-5-12)18-11-8-14(15(18)19)17-9-2-1-3-10-17/h4-7,14H,1-3,8-11H2
InChIKey
GXGWQUTZOBNBNJ-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-3-piperidin-1-ylpyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.1186 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.125876 166.4
[M+Na]+ 301.107818 172.3
[M-H]- 277.111324 172.1
[M+NH4]+ 296.152423 181.7
[M+K]+ 317.081758 166.6
[M+H-H2O]+ 261.115860 157.0
[M+HCOO]- 323.116801 178.2
[M+CH3COO]- 337.132451 176.4
[M+Na-2H]- 299.093266 165.3
[M]+ 278.11805142 161.6
[M]- 278.11914858 161.6
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.