CID 11439

Succinimide

Structural Information

Molecular Formula
C4H5NO2
SMILES
C1CC(=O)NC1=O
InChI
InChI=1S/C4H5NO2/c6-3-1-2-4(7)5-3/h1-2H2,(H,5,6,7)
InChIKey
KZNICNPSHKQLFF-UHFFFAOYSA-N
Compound name
pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

185
References

63914
Patents

99.03203 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.03931 115.7
[M+Na]+ 122.02125 124.1
[M-H]- 98.024754 116.7
[M+NH4]+ 117.06585 138.6
[M+K]+ 137.99519 123.0
[M+H-H2O]+ 82.029290 110.6
[M+HCOO]- 144.03023 137.7
[M+CH3COO]- 158.04588 160.3
[M+Na-2H]- 120.00670 121.0
[M]+ 99.031481 112.0
[M]- 99.032579 112.0
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