CID 51358339

Benzofuran-6-ylboronic acid

Structural Information

Molecular Formula
C8H7BO3
SMILES
B(C1=CC2=C(C=C1)C=CO2)(O)O
InChI
InChI=1S/C8H7BO3/c10-9(11)7-2-1-6-3-4-12-8(6)5-7/h1-5,10-11H
InChIKey
IBCSNLAKMCMGCZ-UHFFFAOYSA-N
Compound name
1-benzofuran-6-ylboronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

162.04883 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.05611 128.1
[M+Na]+ 185.03805 140.9
[M+NH4]+ 180.08265 136.8
[M+K]+ 201.01199 138.0
[M-H]- 161.04155 130.6
[M+Na-2H]- 183.02350 133.9
[M]+ 162.04828 130.6
[M]- 162.04938 130.6
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