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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.99888 164.5
[M+Na]+ 345.98082 177.3
[M-H]- 321.98432 168.3
[M+NH4]+ 341.02542 179.7
[M+K]+ 361.95476 169.7
[M+H-H2O]+ 305.98886 156.9
[M+HCOO]- 367.98980 175.1
[M+CH3COO]- 382.00545 176.3
[M+Na-2H]- 343.96627 169.4
[M]+ 322.99105 168.8
[M]- 322.99215 168.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.