CID 3046422

62064-77-1

Structural Information

Molecular Formula

C₁₀H₁₄FNO

SMILES

CC(C(C1=CC=C(C=C1)F)OC)N

InChI

InChI=1S/C10H14FNO/c1-7(12)10(13-2)8-3-5-9(11)6-4-8/h3-7,10H,12H2,1-2H3

InChIKey

RRQYHMOOYYTCQG-UHFFFAOYSA-N

Compound name

1-(4-fluorophenyl)-1-methoxypropan-2-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 183.10594 Da
Monoisotopic Mass: 1.2
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]+	184.113216	139.7
[M+Na]+	206.095158	146.2
[M-H]-	182.098664	141.5
[M+NH4]+	201.139763	159.1
[M+K]+	222.069098	144.7
[M+H-H2O]+	166.103200	132.8
[M+HCOO]-	228.104141	161.5
[M+CH3COO]-	242.119791	186.1
[M+Na-2H]-	204.080606	142.7
[M]+	183.10539142	137.5
[M]-	183.10648858	137.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.