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
4
Annotation Hits

0
References

950
Patents

323.87854 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.88582 151.4
[M+Na]+ 346.86776 164.8
[M-H]- 322.87126 161.0
[M+NH4]+ 341.91236 172.3
[M+K]+ 362.84170 151.2
[M+H-H2O]+ 306.87580 160.8
[M+HCOO]- 368.87674 168.2
[M+CH3COO]- 382.89239 166.7
[M+Na-2H]- 344.85321 160.3
[M]+ 323.87799 188.3
[M]- 323.87909 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