CID 21465395

2-[4-(aminomethyl)phenoxy]ethan-1-ol hydrochloride

Structural Information

Molecular Formula

C₉H₁₃NO₂

SMILES

C1=CC(=CC=C1CN)OCCO

InChI

InChI=1S/C9H13NO2/c10-7-8-1-3-9(4-2-8)12-6-5-11/h1-4,11H,5-7,10H2

InChIKey

GEHZGEZFRQBILO-UHFFFAOYSA-N

Compound name

2-[4-(aminomethyl)phenoxy]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 167.09464 Da
Monoisotopic Mass: 0.1
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]+	168.10192	134.9
[M+Na]+	190.08386	146.2
[M+NH4]+	185.12846	143.0
[M+K]+	206.05780	140.3
[M-H]-	166.08736	136.9
[M+Na-2H]-	188.06931	141.2
[M]+	167.09409	136.9
[M]-	167.09519	136.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe