CID 13828989

1-(2-aminoethyl)pyrrolidine-2,5-dione hydrochloride

Structural Information

Molecular Formula

C₆H₁₀N₂O₂

SMILES

C1CC(=O)N(C1=O)CCN

InChI

InChI=1S/C6H10N2O2/c7-3-4-8-5(9)1-2-6(8)10/h1-4,7H2

InChIKey

SHYMHDDMXRVUFN-UHFFFAOYSA-N

Compound name

1-(2-aminoethyl)pyrrolidine-2,5-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 236
Patents: 142.07423 Da
Monoisotopic Mass: -1.8
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	127.7
[M+Na]+	165.063448	135.7
[M-H]-	141.066954	129.6
[M+NH4]+	160.108053	149.3
[M+K]+	181.037388	134.5
[M+H-H2O]+	125.071490	121.8
[M+HCOO]-	187.072431	150.9
[M+CH3COO]-	201.088081	174.4
[M+Na-2H]-	163.048896	131.1
[M]+	142.07368142	125.3
[M]-	142.07477858	125.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe