CID 10989408

76578-79-5

Structural Information

Molecular Formula

C₁₄H₉ClN₂O₂

SMILES

C1=CC(=CC=C1O)OC2=CN=C3C=C(C=CC3=N2)Cl

InChI

InChI=1S/C14H9ClN2O2/c15-9-1-6-12-13(7-9)16-8-14(17-12)19-11-4-2-10(18)3-5-11/h1-8,18H

InChIKey

UVYFSLAJRJHGJB-UHFFFAOYSA-N

Compound name

4-(6-chloroquinoxalin-2-yl)oxyphenol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 82
Patents: 272.03525 Da
Monoisotopic Mass: 3.3
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]+	273.04253	157.9
[M+Na]+	295.02447	175.9
[M+NH4]+	290.06907	166.9
[M+K]+	310.99841	167.0
[M-H]-	271.02797	162.3
[M+Na-2H]-	293.00992	168.0
[M]+	272.03470	162.2
[M]-	272.03580	162.2

Literature stripe

literature stripe

Patent stripe

patents stripe