CID 3076806

Alpha-p-chlorophenylsuccinic acid n-(3-pyridyl)imide

Structural Information

Molecular Formula
C15H11ClN2O2
SMILES
C1C(C(=O)N(C1=O)C2=CN=CC=C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C15H11ClN2O2/c16-11-5-3-10(4-6-11)13-8-14(19)18(15(13)20)12-2-1-7-17-9-12/h1-7,9,13H,8H2
InChIKey
XVWYLDOZOVAJSE-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-1-pyridin-3-ylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.0509 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.05818 163.3
[M+Na]+ 309.04012 173.5
[M-H]- 285.04362 170.8
[M+NH4]+ 304.08472 178.8
[M+K]+ 325.01406 167.2
[M+H-H2O]+ 269.04816 154.4
[M+HCOO]- 331.04910 180.0
[M+CH3COO]- 345.06475 175.5
[M+Na-2H]- 307.02557 164.9
[M]+ 286.05035 164.1
[M]- 286.05145 164.1
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.