CID 175927

8-bromo-2,3,4-trichlorodibenzofuran

Structural Information

Molecular Formula
C12H4BrCl3O
SMILES
C1=CC2=C(C=C1Br)C3=CC(=C(C(=C3O2)Cl)Cl)Cl
InChI
InChI=1S/C12H4BrCl3O/c13-5-1-2-9-6(3-5)7-4-8(14)10(15)11(16)12(7)17-9/h1-4H
InChIKey
HSGAYFKTYSUSKW-UHFFFAOYSA-N
Compound name
8-bromo-2,3,4-trichlorodibenzofuran
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

347.8511 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.85838 164.5
[M+Na]+ 370.84032 173.7
[M+NH4]+ 365.88492 171.7
[M+K]+ 386.81426 170.9
[M-H]- 346.84382 167.7
[M+Na-2H]- 368.82577 168.1
[M]+ 347.85055 166.8
[M]- 347.85165 166.8
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.