CID 11031651

2-(4-phenoxyphenoxy)ethanamine

Structural Information

Molecular Formula

C₁₄H₁₅NO₂

SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)OCCN

InChI

InChI=1S/C14H15NO2/c15-10-11-16-12-6-8-14(9-7-12)17-13-4-2-1-3-5-13/h1-9H,10-11,15H2

InChIKey

FBLANPWAVFBRNS-UHFFFAOYSA-N

Compound name

2-(4-phenoxyphenoxy)ethanamine

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 2
References: 56
Patents: 229.11028 Da
Monoisotopic Mass: 2.7
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]+	230.11756	150.5
[M+Na]+	252.09950	157.1
[M-H]-	228.10300	156.5
[M+NH4]+	247.14410	167.6
[M+K]+	268.07344	153.8
[M+H-H2O]+	212.10754	142.6
[M+HCOO]-	274.10848	175.7
[M+CH3COO]-	288.12413	191.5
[M+Na-2H]-	250.08495	157.2
[M]+	229.10973	151.0
[M]-	229.11083	151.0

Literature stripe

literature stripe

Patent stripe

patents stripe