CID 3036288

Phthalimidine, n-(2-oxo-3-piperidyl)-

Structural Information

Molecular Formula
C13H14N2O2
SMILES
C1CC(C(=O)NC1)N2CC3=CC=CC=C3C2=O
InChI
InChI=1S/C13H14N2O2/c16-12-11(6-3-7-14-12)15-8-9-4-1-2-5-10(9)13(15)17/h1-2,4-5,11H,3,6-8H2,(H,14,16)
InChIKey
JMIPGSWDKXXJTC-UHFFFAOYSA-N
Compound name
2-(2-oxopiperidin-3-yl)-3H-isoindol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

230.10553 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.112806 151.8
[M+Na]+ 253.094748 158.8
[M-H]- 229.098254 154.9
[M+NH4]+ 248.139353 168.9
[M+K]+ 269.068688 154.1
[M+H-H2O]+ 213.102790 143.8
[M+HCOO]- 275.103731 167.9
[M+CH3COO]- 289.119381 162.8
[M+Na-2H]- 251.080196 154.0
[M]+ 230.10498142 146.1
[M]- 230.10607858 146.1
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

patents stripe