CID 58050102

1213768-48-9

Structural Information

Molecular Formula
C15H14BBrO2
SMILES
B(C1=CC2=C(C=C1)C3=C(C2(C)C)C=C(C=C3)Br)(O)O
InChI
InChI=1S/C15H14BBrO2/c1-15(2)13-7-9(16(18)19)3-5-11(13)12-6-4-10(17)8-14(12)15/h3-8,18-19H,1-2H3
InChIKey
CYZUULREWZKGJP-UHFFFAOYSA-N
Compound name
(7-bromo-9,9-dimethylfluoren-2-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

316.027 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.03428 165.8
[M+Na]+ 339.01622 169.5
[M+NH4]+ 334.06082 172.4
[M+K]+ 354.99016 168.6
[M-H]- 315.01972 166.6
[M+Na-2H]- 337.00167 168.2
[M]+ 316.02645 165.6
[M]- 316.02755 165.6
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