CID 2433155

4-(4-ethoxyphenoxy)aniline

Structural Information

Molecular Formula

C₁₄H₁₅NO₂

SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)N

InChI

InChI=1S/C14H15NO2/c1-2-16-12-7-9-14(10-8-12)17-13-5-3-11(15)4-6-13/h3-10H,2,15H2,1H3

InChIKey

CDPWNMXJIYCVIK-UHFFFAOYSA-N

Compound name

4-(4-ethoxyphenoxy)aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 7
Patents: 229.11028 Da
Monoisotopic Mass: 2.8
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	150.6
[M+Na]+	252.09950	158.1
[M-H]-	228.10300	157.1
[M+NH4]+	247.14410	168.1
[M+K]+	268.07344	154.9
[M+H-H2O]+	212.10754	143.0
[M+HCOO]-	274.10848	175.8
[M+CH3COO]-	288.12413	192.6
[M+Na-2H]-	250.08495	156.6
[M]+	229.10973	151.6
[M]-	229.11083	151.6

Literature stripe

literature stripe

Patent stripe

patents stripe