CID 45090882

5-methoxypyridine-2-boronic acid

Structural Information

Molecular Formula
C6H8BNO3
SMILES
B(C1=NC=C(C=C1)OC)(O)O
InChI
InChI=1S/C6H8BNO3/c1-11-5-2-3-6(7(9)10)8-4-5/h2-4,9-10H,1H3
InChIKey
QXWTVLPBRHGDBI-UHFFFAOYSA-N
Compound name
(5-methoxypyridin-2-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

153.05972 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.06700 128.7
[M+Na]+ 176.04894 140.4
[M+NH4]+ 171.09354 135.9
[M+K]+ 192.02288 136.3
[M-H]- 152.05244 128.6
[M+Na-2H]- 174.03439 134.4
[M]+ 153.05917 130.1
[M]- 153.06027 130.1
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