CID 82290

2,8-dibromodibenzofuran

Structural Information

Molecular Formula
C12H6Br2O
SMILES
C1=CC2=C(C=C1Br)C3=C(O2)C=CC(=C3)Br
InChI
InChI=1S/C12H6Br2O/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6H
InChIKey
UFCZRCPQBWIXTR-UHFFFAOYSA-N
Compound name
2,8-dibromodibenzofuran
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

721
Patents

323.87854 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.885816 151.4
[M+Na]+ 346.867758 164.8
[M-H]- 322.871264 161.0
[M+NH4]+ 341.912363 172.3
[M+K]+ 362.841698 151.2
[M+H-H2O]+ 306.875800 160.8
[M+HCOO]- 368.876741 168.2
[M+CH3COO]- 382.892391 166.7
[M+Na-2H]- 344.853206 160.3
[M]+ 323.87799142 188.3
[M]- 323.87908858 188.3
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

patents stripe