CID 3248350

Methyl 2-(2-aminoacetamido)acetate hydrochloride

Structural Information

Molecular Formula

C₅H₁₀N₂O₃

SMILES

COC(=O)CNC(=O)CN

InChI

InChI=1S/C5H10N2O3/c1-10-5(9)3-7-4(8)2-6/h2-3,6H2,1H3,(H,7,8)

InChIKey

XXNZVJWJWMVONK-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 264
Patents: 146.06914 Da
Monoisotopic Mass: -0.3
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]+	147.07642	129.7
[M+Na]+	169.05836	135.8
[M-H]-	145.06186	129.7
[M+NH4]+	164.10296	150.1
[M+K]+	185.03230	136.5
[M+H-H2O]+	129.06640	124.2
[M+HCOO]-	191.06734	154.4
[M+CH3COO]-	205.08299	177.8
[M+Na-2H]-	167.04381	134.0
[M]+	146.06859	129.3
[M]-	146.06969	129.3

Literature stripe

literature stripe

Patent stripe

patents stripe