CID 4589187

Biphenyl-2-boronic acid

Structural Information

Molecular Formula
C12H11BO2
SMILES
B(C1=CC=CC=C1C2=CC=CC=C2)(O)O
InChI
InChI=1S/C12H11BO2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,14-15H
InChIKey
HYCYKHYFIWHGEX-UHFFFAOYSA-N
Compound name
(2-phenylphenyl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

2919
Patents

198.0852 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.092476 140.7
[M+Na]+ 221.074418 147.6
[M-H]- 197.077924 145.0
[M+NH4]+ 216.119023 158.4
[M+K]+ 237.048358 143.9
[M+H-H2O]+ 181.082460 134.3
[M+HCOO]- 243.083401 162.0
[M+CH3COO]- 257.099051 179.4
[M+Na-2H]- 219.059866 146.8
[M]+ 198.08465142 138.3
[M]- 198.08574858 138.3
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