CID 10199126

(dimethylphenylsilyl) boronic acid pinacol ester

Structural Information

Molecular Formula
C14H23BO2Si
SMILES
B1(OC(C(O1)(C)C)(C)C)[Si](C)(C)C2=CC=CC=C2
InChI
InChI=1S/C14H23BO2Si/c1-13(2)14(3,4)17-15(16-13)18(5,6)12-10-8-7-9-11-12/h7-11H,1-6H3
InChIKey
ARMSAQNLTKGMGM-UHFFFAOYSA-N
Compound name
dimethyl-phenyl-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

53
Patents

262.15604 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.16332 154.4
[M+Na]+ 285.14526 162.6
[M-H]- 261.14876 162.8
[M+NH4]+ 280.18986 175.5
[M+K]+ 301.11920 163.0
[M+H-H2O]+ 245.15330 150.4
[M+HCOO]- 307.15424 173.3
[M+CH3COO]- 321.16989 194.3
[M+Na-2H]- 283.13071 161.3
[M]+ 262.15549 157.4
[M]- 262.15659 157.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe