CID 139595102

Quinoxyfen tp

Structural Information

Molecular Formula

C₁₅H₈Cl₂FNO₂

SMILES

C1=CC(=CC=C1OC2=C3C(=CC(=CC3=NC=C2O)Cl)Cl)F

InChI

InChI=1S/C15H8Cl2FNO2/c16-8-5-11(17)14-12(6-8)19-7-13(20)15(14)21-10-3-1-9(18)2-4-10/h1-7,20H

InChIKey

GNQKYTVIIUPMTP-UHFFFAOYSA-N

Compound name

5,7-dichloro-4-(4-fluorophenoxy)quinolin-3-ol

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 0
Patents: 322.9916 Da
Monoisotopic Mass: 4.7
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]+	323.998876	164.5
[M+Na]+	345.980818	177.3
[M-H]-	321.984324	168.3
[M+NH4]+	341.025423	179.7
[M+K]+	361.954758	169.7
[M+H-H2O]+	305.988860	156.9
[M+HCOO]-	367.989801	175.1
[M+CH3COO]-	382.005451	176.3
[M+Na-2H]-	343.966266	169.4
[M]+	322.99105142	168.8
[M]-	322.99214858	168.8

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.