CID 14094492

2490404-38-9

Structural Information

Molecular Formula

C₆H₁₁NO₄

SMILES

CCOC(=O)CNCC(=O)O

InChI

InChI=1S/C6H11NO4/c1-2-11-6(10)4-7-3-5(8)9/h7H,2-4H2,1H3,(H,8,9)

InChIKey

VVKZCUGDWOHEBO-UHFFFAOYSA-N

Compound name

2-[(2-ethoxy-2-oxoethyl)amino]acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 78
Patents: 161.0688 Da
Monoisotopic Mass: -2.6
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]+	162.07608	133.7
[M+Na]+	184.05802	140.9
[M+NH4]+	179.10262	139.1
[M+K]+	200.03196	138.3
[M-H]-	160.06152	130.9
[M+Na-2H]-	182.04347	135.0
[M]+	161.06825	133.3
[M]-	161.06935	133.3

Literature stripe

literature stripe

Patent stripe

patents stripe