CID 428913

N-(2-aminoethyl)glycine

Structural Information

Molecular Formula

C₄H₁₀N₂O₂

SMILES

C(CNCC(=O)O)N

InChI

InChI=1S/C4H10N2O2/c5-1-2-6-3-4(7)8/h6H,1-3,5H2,(H,7,8)

InChIKey

PIINGYXNCHTJTF-UHFFFAOYSA-N

Compound name

2-(2-aminoethylamino)acetic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 73
References: 39036
Patents: 118.07423 Da
Monoisotopic Mass: -3.8
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]+	119.08151	123.4
[M+Na]+	141.06345	129.2
[M-H]-	117.06695	121.9
[M+NH4]+	136.10805	144.1
[M+K]+	157.03739	128.8
[M+H-H2O]+	101.07149	118.2
[M+HCOO]-	163.07243	147.3
[M+CH3COO]-	177.08808	171.5
[M+Na-2H]-	139.04890	128.9
[M]+	118.07368	120.7
[M]-	118.07478	120.7

Literature stripe

literature stripe

Patent stripe

patents stripe