CID 18794474

4-(pyridin-4-yloxy)phenol

Structural Information

Molecular Formula

C₁₁H₉NO₂

SMILES

C1=CC(=CC=C1O)OC2=CC=NC=C2

InChI

InChI=1S/C11H9NO2/c13-9-1-3-10(4-2-9)14-11-5-7-12-8-6-11/h1-8,13H

InChIKey

JPVVRFKXDFIJLM-UHFFFAOYSA-N

Compound name

4-pyridin-4-yloxyphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 23
Patents: 187.06332 Da
Monoisotopic Mass: 2.0
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]+	188.070596	137.2
[M+Na]+	210.052538	145.6
[M-H]-	186.056044	141.6
[M+NH4]+	205.097143	154.7
[M+K]+	226.026478	142.4
[M+H-H2O]+	170.060580	129.7
[M+HCOO]-	232.061521	160.3
[M+CH3COO]-	246.077171	178.3
[M+Na-2H]-	208.037986	145.9
[M]+	187.06277142	137.1
[M]-	187.06386858	137.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe