CID 54762

1,8-dichlorodibenzofuran

Structural Information

Molecular Formula
C12H6Cl2O
SMILES
C1=CC2=C(C(=C1)Cl)C3=C(O2)C=CC(=C3)Cl
InChI
InChI=1S/C12H6Cl2O/c13-7-4-5-10-8(6-7)12-9(14)2-1-3-11(12)15-10/h1-6H
InChIKey
UAFNQQBPUWFPGC-UHFFFAOYSA-N
Compound name
1,8-dichlorodibenzofuran
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

235.97957 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.98685 143.0
[M+Na]+ 258.96879 161.6
[M+NH4]+ 254.01339 154.7
[M+K]+ 274.94273 153.5
[M-H]- 234.97229 148.8
[M+Na-2H]- 256.95424 151.3
[M]+ 235.97902 148.3
[M]- 235.98012 148.3
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.