CID 3841607

4'-bromo-4-biphenylboronic acid

Structural Information

Molecular Formula
C12H10BBrO2
SMILES
B(C1=CC=C(C=C1)C2=CC=C(C=C2)Br)(O)O
InChI
InChI=1S/C12H10BBrO2/c14-12-7-3-10(4-8-12)9-1-5-11(6-2-9)13(15)16/h1-8,15-16H
InChIKey
HQAGDFJHKPSZHT-UHFFFAOYSA-N
Compound name
[4-(4-bromophenyl)phenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

176
Patents

275.99573 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.00301 150.4
[M+Na]+ 298.98495 155.2
[M+NH4]+ 294.02955 155.4
[M+K]+ 314.95889 154.7
[M-H]- 274.98845 152.6
[M+Na-2H]- 296.97040 155.9
[M]+ 275.99518 150.6
[M]- 275.99628 150.6
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