CID 10750766

2-(4-(trifluoromethoxy)phenyl)ethanol

Structural Information

Molecular Formula

C₉H₉F₃O₂

SMILES

C1=CC(=CC=C1CCO)OC(F)(F)F

InChI

InChI=1S/C9H9F3O2/c10-9(11,12)14-8-3-1-7(2-4-8)5-6-13/h1-4,13H,5-6H2

InChIKey

RILZRCJGXSFXNE-UHFFFAOYSA-N

Compound name

2-[4-(trifluoromethoxy)phenyl]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13401
Patents: 206.05547 Da
Monoisotopic Mass: 2.0
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]+	207.06275	146.2
[M+Na]+	229.04469	155.1
[M+NH4]+	224.08929	151.7
[M+K]+	245.01863	150.0
[M-H]-	205.04819	142.7
[M+Na-2H]-	227.03014	150.1
[M]+	206.05492	146.2
[M]-	206.05602	146.2

Literature stripe

literature stripe

Patent stripe

patents stripe