CID 2763084

459856-12-3

Structural Information

Molecular Formula
C7H10BNO3
SMILES
B(C1=C(N=C(C=C1)OC)C)(O)O
InChI
InChI=1S/C7H10BNO3/c1-5-6(8(10)11)3-4-7(9-5)12-2/h3-4,10-11H,1-2H3
InChIKey
CWXWIICBKIHZFC-UHFFFAOYSA-N
Compound name
(6-methoxy-2-methylpyridin-3-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

101
Patents

167.07538 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.08266 132.9
[M+Na]+ 190.06460 144.8
[M+NH4]+ 185.10920 140.0
[M+K]+ 206.03854 140.7
[M-H]- 166.06810 132.8
[M+Na-2H]- 188.05005 138.2
[M]+ 167.07483 134.4
[M]- 167.07593 134.4
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