CID 44118243

2-fluoro-4-methylpyridine-5-boronic acid

Structural Information

Molecular Formula
C6H7BFNO2
SMILES
B(C1=CN=C(C=C1C)F)(O)O
InChI
InChI=1S/C6H7BFNO2/c1-4-2-6(8)9-3-5(4)7(10)11/h2-3,10-11H,1H3
InChIKey
BAVHOAIWOSIBRD-UHFFFAOYSA-N
Compound name
(6-fluoro-4-methylpyridin-3-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

99
Patents

155.05539 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.06267 129.2
[M+Na]+ 178.04461 140.7
[M+NH4]+ 173.08921 136.1
[M+K]+ 194.01855 136.3
[M-H]- 154.04811 128.0
[M+Na-2H]- 176.03006 134.3
[M]+ 155.05484 130.2
[M]- 155.05594 130.2
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