CID 18619272

353292-81-6

Structural Information

Molecular Formula

C₉H₁₁NO₄

SMILES

CCOC(=O)COC1=C(C=CC=N1)O

InChI

InChI=1S/C9H11NO4/c1-2-13-8(12)6-14-9-7(11)4-3-5-10-9/h3-5,11H,2,6H2,1H3

InChIKey

ABMQGSICTIPMKL-UHFFFAOYSA-N

Compound name

ethyl 2-(3-hydroxypyridin-2-yl)oxyacetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 66
Patents: 197.0688 Da
Monoisotopic Mass: 1.1
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]+	198.07608	139.8
[M+Na]+	220.05802	147.6
[M-H]-	196.06152	140.9
[M+NH4]+	215.10262	157.1
[M+K]+	236.03196	146.7
[M+H-H2O]+	180.06606	133.1
[M+HCOO]-	242.06700	161.7
[M+CH3COO]-	256.08265	179.9
[M+Na-2H]-	218.04347	145.7
[M]+	197.06825	143.1
[M]-	197.06935	143.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe