CID 43637675

3-(ethylamino)pyrrolidine-2,5-dione

Structural Information

Molecular Formula

C₆H₁₀N₂O₂

SMILES

CCNC1CC(=O)NC1=O

InChI

InChI=1S/C6H10N2O2/c1-2-7-4-3-5(9)8-6(4)10/h4,7H,2-3H2,1H3,(H,8,9,10)

InChIKey

XLNDPYUHSNCDIZ-UHFFFAOYSA-N

Compound name

3-(ethylamino)pyrrolidine-2,5-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 142.07423 Da
Monoisotopic Mass: -1.0
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]+	143.081506	128.1
[M+Na]+	165.063448	135.7
[M-H]-	141.066954	129.1
[M+NH4]+	160.108053	149.2
[M+K]+	181.037388	133.9
[M+H-H2O]+	125.071490	122.5
[M+HCOO]-	187.072431	150.5
[M+CH3COO]-	201.088081	172.5
[M+Na-2H]-	163.048896	132.1
[M]+	142.07368142	124.8
[M]-	142.07477858	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.