CID 135339

N-(2-oxo-3-piperidyl)phthalimide

Structural Information

Molecular Formula
C13H12N2O3
SMILES
C1CC(C(=O)NC1)N2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C13H12N2O3/c16-11-10(6-3-7-14-11)15-12(17)8-4-1-2-5-9(8)13(15)18/h1-2,4-5,10H,3,6-7H2,(H,14,16)
InChIKey
ZLYHJKFZUWNUEQ-UHFFFAOYSA-N
Compound name
2-(2-oxopiperidin-3-yl)isoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

152
Patents

244.0848 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.09208 153.6
[M+Na]+ 267.07402 161.7
[M-H]- 243.07752 157.2
[M+NH4]+ 262.11862 170.3
[M+K]+ 283.04796 157.0
[M+H-H2O]+ 227.08206 145.9
[M+HCOO]- 289.08300 170.1
[M+CH3COO]- 303.09865 189.4
[M+Na-2H]- 265.05947 155.2
[M]+ 244.08425 149.1
[M]- 244.08535 149.1
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

patents stripe