CID 61553432

1248482-98-5

Structural Information

Molecular Formula

C₁₀H₁₄FNO

SMILES

CNC(COC)C1=CC=C(C=C1)F

InChI

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

InChIKey

QLRKJFKCZOWBOM-UHFFFAOYSA-N

Compound name

1-(4-fluorophenyl)-2-methoxy-N-methylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 183.10594 Da
Monoisotopic Mass: 1.3
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]+	184.11322	138.7
[M+Na]+	206.09516	145.5
[M-H]-	182.09866	141.0
[M+NH4]+	201.13976	158.4
[M+K]+	222.06910	143.8
[M+H-H2O]+	166.10320	131.6
[M+HCOO]-	228.10414	162.1
[M+CH3COO]-	242.11979	185.9
[M+Na-2H]-	204.08061	144.1
[M]+	183.10539	138.2
[M]-	183.10649	138.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe