CID 121296730

4-(3-bromophenyl)-6-phenyldibenzo[b,d]furan

Structural Information

Molecular Formula
C24H15BrO
SMILES
C1=CC=C(C=C1)C2=CC=CC3=C2OC4=C3C=CC=C4C5=CC(=CC=C5)Br
InChI
InChI=1S/C24H15BrO/c25-18-10-4-9-17(15-18)20-12-6-14-22-21-13-5-11-19(23(21)26-24(20)22)16-7-2-1-3-8-16/h1-15H
InChIKey
QSUPTHBRZMHSGI-UHFFFAOYSA-N
Compound name
4-(3-bromophenyl)-6-phenyldibenzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

398.03064 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.03792 194.2
[M+Na]+ 421.01986 207.0
[M-H]- 397.02336 208.9
[M+NH4]+ 416.06446 211.2
[M+K]+ 436.99380 195.0
[M+H-H2O]+ 381.02790 192.6
[M+HCOO]- 443.02884 214.4
[M+CH3COO]- 457.04449 207.6
[M+Na-2H]- 419.00531 199.9
[M]+ 398.03009 214.9
[M]- 398.03119 214.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe