CID 296861

3-bromodibenzo[b,d]furan

Structural Information

Molecular Formula
C12H7BrO
SMILES
C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)Br
InChI
InChI=1S/C12H7BrO/c13-8-5-6-10-9-3-1-2-4-11(9)14-12(10)7-8/h1-7H
InChIKey
AZFABGHLDGJASW-UHFFFAOYSA-N
Compound name
3-bromodibenzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1748
Patents

245.96803 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.97531 143.2
[M+Na]+ 268.95725 149.9
[M+NH4]+ 264.00185 150.4
[M+K]+ 284.93119 149.4
[M-H]- 244.96075 146.9
[M+Na-2H]- 266.94270 147.9
[M]+ 245.96748 144.3
[M]- 245.96858 144.3
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