CID 59251805

944401-71-2

Structural Information

Molecular Formula
C11H16BFN2O2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2F)N
InChI
InChI=1S/C11H16BFN2O2/c1-10(2)11(3,4)17-12(16-10)7-6-15-9(14)5-8(7)13/h5-6H,1-4H3,(H2,14,15)
InChIKey
VRAOZHCCDMWQFX-UHFFFAOYSA-N
Compound name
4-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

238.12889 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.13617 150.7
[M+Na]+ 261.11811 162.0
[M+NH4]+ 256.16271 160.4
[M+K]+ 277.09205 155.6
[M-H]- 237.12161 154.9
[M+Na-2H]- 259.10356 157.7
[M]+ 238.12834 153.7
[M]- 238.12944 153.7
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