CID 74969

2088-24-6

Structural Information

Molecular Formula

C₉H₁₀O₄

SMILES

COC1=CC(=CC=C1)OCC(=O)O

InChI

InChI=1S/C9H10O4/c1-12-7-3-2-4-8(5-7)13-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)

InChIKey

AHDPQRIYMMZJTF-UHFFFAOYSA-N

Compound name

2-(3-methoxyphenoxy)acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8
References: 355
Patents: 182.0579 Da
Monoisotopic Mass: 1.4
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]+	183.06518	136.3
[M+Na]+	205.04712	147.9
[M+NH4]+	200.09172	143.5
[M+K]+	221.02106	143.2
[M-H]-	181.05062	136.7
[M+Na-2H]-	203.03257	141.9
[M]+	182.05735	137.8
[M]-	182.05845	137.8

Literature stripe

literature stripe

Patent stripe

patents stripe