CID 14739363

128388-54-5

Structural Information

Molecular Formula
C18H15BO2
SMILES
B(C1=CC(=CC(=C1)C2=CC=CC=C2)C3=CC=CC=C3)(O)O
InChI
InChI=1S/C18H15BO2/c20-19(21)18-12-16(14-7-3-1-4-8-14)11-17(13-18)15-9-5-2-6-10-15/h1-13,20-21H
InChIKey
MRBZYVMZUBUDAX-UHFFFAOYSA-N
Compound name
(3,5-diphenylphenyl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

734
Patents

274.11652 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.12380 164.4
[M+Na]+ 297.10574 180.8
[M+NH4]+ 292.15034 173.6
[M+K]+ 313.07968 172.2
[M-H]- 273.10924 171.2
[M+Na-2H]- 295.09119 176.1
[M]+ 274.11597 168.9
[M]- 274.11707 168.9
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