CID 24274288

4-(4-fluorophenyl)oxan-4-amine hydrochloride

Structural Information

Molecular Formula

C₁₁H₁₄FNO

SMILES

C1COCCC1(C2=CC=C(C=C2)F)N

InChI

InChI=1S/C11H14FNO/c12-10-3-1-9(2-4-10)11(13)5-7-14-8-6-11/h1-4H,5-8,13H2

InChIKey

FWBLYJGNTBGREE-UHFFFAOYSA-N

Compound name

4-(4-fluorophenyl)oxan-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 195.10594 Da
Monoisotopic Mass: 1.1
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]+	196.11322	143.3
[M+Na]+	218.09516	155.0
[M+NH4]+	213.13976	153.6
[M+K]+	234.06910	146.5
[M-H]-	194.09866	148.3
[M+Na-2H]-	216.08061	151.9
[M]+	195.10539	146.5
[M]-	195.10649	146.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe