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]+ 279.12588 166.4
[M+Na]+ 301.10782 172.3
[M-H]- 277.11132 172.1
[M+NH4]+ 296.15242 181.7
[M+K]+ 317.08176 166.6
[M+H-H2O]+ 261.11586 157.0
[M+HCOO]- 323.11680 178.2
[M+CH3COO]- 337.13245 176.4
[M+Na-2H]- 299.09327 165.3
[M]+ 278.11805 161.6
[M]- 278.11915 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.