CID 124706

2087-41-4

Structural Information

Molecular Formula

C₆H₁₂N₂O₃

SMILES

CCOC(=O)CNC(=O)CN

InChI

InChI=1S/C6H12N2O3/c1-2-11-6(10)4-8-5(9)3-7/h2-4,7H2,1H3,(H,8,9)

InChIKey

LFAVEINQLWIXRA-UHFFFAOYSA-N

Compound name

ethyl 2-[(2-aminoacetyl)amino]acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 296
Patents: 160.0848 Da
Monoisotopic Mass: 0.1
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]+	161.09208	134.6
[M+Na]+	183.07402	141.3
[M+NH4]+	178.11862	140.2
[M+K]+	199.04796	138.4
[M-H]-	159.07752	132.9
[M+Na-2H]-	181.05947	136.2
[M]+	160.08425	134.4
[M]-	160.08535	134.4

Literature stripe

literature stripe

Patent stripe

patents stripe