CID 300109

N-(phenoxyacetyl)glycine

Structural Information

Molecular Formula

C₁₀H₁₁NO₄

SMILES

C1=CC=C(C=C1)OCC(=O)NCC(=O)O

InChI

InChI=1S/C10H11NO4/c12-9(11-6-10(13)14)7-15-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)

InChIKey

MYTAKEVMLYCYIE-UHFFFAOYSA-N

Compound name

2-[(2-phenoxyacetyl)amino]acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 44
Patents: 209.0688 Da
Monoisotopic Mass: 0.8
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]+	210.07608	144.8
[M+Na]+	232.05802	154.2
[M+NH4]+	227.10262	150.8
[M+K]+	248.03196	150.1
[M-H]-	208.06152	144.8
[M+Na-2H]-	230.04347	149.5
[M]+	209.06825	145.6
[M]-	209.06935	145.6

Literature stripe

literature stripe

Patent stripe

patents stripe