CID 130502

N-(3-pyridyl)-3-phenylsuccinimide

Structural Information

Molecular Formula
C15H12N2O2
SMILES
C1C(C(=O)N(C1=O)C2=CN=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C15H12N2O2/c18-14-9-13(11-5-2-1-3-6-11)15(19)17(14)12-7-4-8-16-10-12/h1-8,10,13H,9H2
InChIKey
JYHMYXSDHJOVOI-UHFFFAOYSA-N
Compound name
3-phenyl-1-pyridin-3-ylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

23
References

344
Patents

252.08987 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.09715 155.7
[M+Na]+ 275.07909 164.3
[M-H]- 251.08259 163.2
[M+NH4]+ 270.12369 171.5
[M+K]+ 291.05303 159.6
[M+H-H2O]+ 235.08713 146.4
[M+HCOO]- 297.08807 177.2
[M+CH3COO]- 311.10372 168.1
[M+Na-2H]- 273.06454 158.7
[M]+ 252.08932 154.1
[M]- 252.09042 154.1
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