CID 16842

N-ethylsuccinimide

Structural Information

Molecular Formula

SMILES

CCN1C(=O)CCC1=O

InChI

InChI=1S/C6H9NO2/c1-2-7-5(8)3-4-6(7)9/h2-4H2,1H3

InChIKey

GHAZCVNUKKZTLG-UHFFFAOYSA-N

Compound name

1-ethylpyrrolidine-2,5-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 24602
Patents: 127.06333 Da
Monoisotopic Mass: -0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	128.07061	125.6
[M+Na]+	150.05255	135.9
[M+NH4]+	145.09715	133.3
[M+K]+	166.02649	132.6
[M-H]-	126.05605	125.5
[M+Na-2H]-	148.03800	129.2
[M]+	127.06278	126.7
[M]-	127.06388	126.7

Literature stripe

literature stripe

Patent stripe

patents stripe