CID 74890663

2,5-dimethoxypyridine-4-boronic acid

Structural Information

Molecular Formula
C7H10BNO4
SMILES
B(C1=CC(=NC=C1OC)OC)(O)O
InChI
InChI=1S/C7H10BNO4/c1-12-6-4-9-7(13-2)3-5(6)8(10)11/h3-4,10-11H,1-2H3
InChIKey
USYZNFPWBSJVMF-UHFFFAOYSA-N
Compound name
(2,5-dimethoxy-4-pyridinyl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

207
Patents

183.07028 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.07756 134.7
[M+Na]+ 206.05950 143.2
[M-H]- 182.06300 135.0
[M+NH4]+ 201.10410 152.3
[M+K]+ 222.03344 142.4
[M+H-H2O]+ 166.06754 128.7
[M+HCOO]- 228.06848 155.3
[M+CH3COO]- 242.08413 176.5
[M+Na-2H]- 204.04495 140.1
[M]+ 183.06973 136.9
[M]- 183.07083 136.9
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

No patent data available for this compound.