CID 173961

2,3-dichloro-6-(2,4-dichlorophenoxy)phenol

Structural Information

Molecular Formula
C12H6Cl4O2
SMILES
C1=CC(=C(C=C1Cl)Cl)OC2=C(C(=C(C=C2)Cl)Cl)O
InChI
InChI=1S/C12H6Cl4O2/c13-6-1-3-9(8(15)5-6)18-10-4-2-7(14)11(16)12(10)17/h1-5,17H
InChIKey
BKWHBKVTXLCASI-UHFFFAOYSA-N
Compound name
2,3-dichloro-6-(2,4-dichlorophenoxy)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

321.9122 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.91948 165.3
[M+Na]+ 344.90142 182.5
[M+NH4]+ 339.94602 174.2
[M+K]+ 360.87536 173.1
[M-H]- 320.90492 168.7
[M+Na-2H]- 342.88687 173.5
[M]+ 321.91165 170.1
[M]- 321.91275 170.1
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.