CID 138040305

[3-(pyridin-2-yl)-1h-pyrazol-4-yl]boronic acid

Structural Information

Molecular Formula
C8H8BN3O2
SMILES
B(C1=C(NN=C1)C2=CC=CC=N2)(O)O
InChI
InChI=1S/C8H8BN3O2/c13-9(14)6-5-11-12-8(6)7-3-1-2-4-10-7/h1-5,13-14H,(H,11,12)
InChIKey
FRWFGSNOOIYNRS-UHFFFAOYSA-N
Compound name
(5-pyridin-2-yl-1H-pyrazol-4-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.07095 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.07823 139.1
[M+Na]+ 212.06017 150.7
[M+NH4]+ 207.10477 145.4
[M+K]+ 228.03411 148.4
[M-H]- 188.06367 139.1
[M+Na-2H]- 210.04562 145.5
[M]+ 189.07040 140.4
[M]- 189.07150 140.4
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

No patent data available for this compound.