CID 130476832

2305252-77-9

Structural Information

Molecular Formula

C₈H₁₂N₂O₂

SMILES

COC1=C(N=CC=C1)C(CN)O

InChI

InChI=1S/C8H12N2O2/c1-12-7-3-2-4-10-8(7)6(11)5-9/h2-4,6,11H,5,9H2,1H3

InChIKey

DFULQECNEMIRMW-UHFFFAOYSA-N

Compound name

2-amino-1-(3-methoxypyridin-2-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 168.08987 Da
Monoisotopic Mass: -0.9
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]+	169.09715	135.0
[M+Na]+	191.07909	145.8
[M+NH4]+	186.12369	142.2
[M+K]+	207.05303	141.2
[M-H]-	167.08259	135.9
[M+Na-2H]-	189.06454	140.6
[M]+	168.08932	136.5
[M]-	168.09042	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.