CID 3391107

Quinoxyfen

Structural Information

Molecular Formula
C15H8Cl2FNO
SMILES
C1=CC(=CC=C1OC2=C3C(=CC(=CC3=NC=C2)Cl)Cl)F
InChI
InChI=1S/C15H8Cl2FNO/c16-9-7-12(17)15-13(8-9)19-6-5-14(15)20-11-3-1-10(18)2-4-11/h1-8H
InChIKey
WRPIRSINYZBGPK-UHFFFAOYSA-N
Compound name
5,7-dichloro-4-(4-fluorophenoxy)quinoline
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

27
References

29264
Patents

306.9967 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.00398 161.8
[M+Na]+ 329.98592 174.3
[M-H]- 305.98942 166.5
[M+NH4]+ 325.03052 178.0
[M+K]+ 345.95986 166.7
[M+H-H2O]+ 289.99396 153.6
[M+HCOO]- 351.99490 173.6
[M+CH3COO]- 366.01055 174.0
[M+Na-2H]- 327.97137 167.7
[M]+ 306.99615 166.0
[M]- 306.99725 166.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.