CID 54758868

4-(t-butyldimethylsilyloxy)-2,3-difluorophenylboronic acid

Structural Information

Molecular Formula
C12H19BF2O3Si
SMILES
B(C1=C(C(=C(C=C1)O[Si](C)(C)C(C)(C)C)F)F)(O)O
InChI
InChI=1S/C12H19BF2O3Si/c1-12(2,3)19(4,5)18-9-7-6-8(13(16)17)10(14)11(9)15/h6-7,16-17H,1-5H3
InChIKey
DODXXNHIJRLFAF-UHFFFAOYSA-N
Compound name
[4-[tert-butyl(dimethyl)silyl]oxy-2,3-difluorophenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

288.11646 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.12374 166.4
[M+Na]+ 311.10568 174.7
[M+NH4]+ 306.15028 170.9
[M+K]+ 327.07962 171.5
[M-H]- 287.10918 162.5
[M+Na-2H]- 309.09113 168.1
[M]+ 288.11591 166.3
[M]- 288.11701 166.3
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