CID 217805

39630-18-7

Structural Information

Molecular Formula
C17H22N2O3
SMILES
COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCCCC3
InChI
InChI=1S/C17H22N2O3/c1-22-15-7-5-14(6-8-15)19-12-13(11-16(19)20)17(21)18-9-3-2-4-10-18/h5-8,13H,2-4,9-12H2,1H3
InChIKey
TWAKYUCUSBHUJX-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.16306 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.17034 173.1
[M+Na]+ 325.15228 183.6
[M+NH4]+ 320.19688 179.7
[M+K]+ 341.12622 179.5
[M-H]- 301.15578 176.3
[M+Na-2H]- 323.13773 178.2
[M]+ 302.16251 175.1
[M]- 302.16361 175.1
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.