CID 42614576

842136-58-7

Structural Information

Molecular Formula
C11H15BFNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=NC(=CC=C2)F
InChI
InChI=1S/C11H15BFNO2/c1-10(2)11(3,4)16-12(15-10)8-6-5-7-9(13)14-8/h5-7H,1-4H3
InChIKey
WGPVNHXZZUGSMO-UHFFFAOYSA-N
Compound name
2-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

223.11798 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.12526 142.1
[M+Na]+ 246.10720 152.6
[M-H]- 222.11070 148.5
[M+NH4]+ 241.15180 162.9
[M+K]+ 262.08114 152.9
[M+H-H2O]+ 206.11524 136.2
[M+HCOO]- 268.11618 161.6
[M+CH3COO]- 282.13183 188.2
[M+Na-2H]- 244.09265 148.6
[M]+ 223.11743 144.0
[M]- 223.11853 144.0
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