CID 59728585

6,9-diphenyl-9h-carbazole-3-boronic acid (contains varying amounts of anhydride)

Structural Information

Molecular Formula
C24H18BNO2
SMILES
B(C1=CC2=C(C=C1)N(C3=C2C=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C5)(O)O
InChI
InChI=1S/C24H18BNO2/c27-25(28)19-12-14-24-22(16-19)21-15-18(17-7-3-1-4-8-17)11-13-23(21)26(24)20-9-5-2-6-10-20/h1-16,27-28H
InChIKey
AIDQRXUWQFRMAQ-UHFFFAOYSA-N
Compound name
(6,9-diphenylcarbazol-3-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

363.14307 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.15035 185.5
[M+Na]+ 386.13229 194.2
[M-H]- 362.13579 193.9
[M+NH4]+ 381.17689 198.6
[M+K]+ 402.10623 186.3
[M+H-H2O]+ 346.14033 176.0
[M+HCOO]- 408.14127 203.9
[M+CH3COO]- 422.15692 195.6
[M+Na-2H]- 384.11774 189.3
[M]+ 363.14252 185.8
[M]- 363.14362 185.8
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