CID 165756867

En300-37080342

Structural Information

Molecular Formula
C17H24BFO2Si
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)F)C#C[Si](C)(C)C
InChI
InChI=1S/C17H24BFO2Si/c1-16(2)17(3,4)21-18(20-16)14-10-13(11-15(19)12-14)8-9-22(5,6)7/h10-12H,1-7H3
InChIKey
YKSPNFUBRXFKAY-UHFFFAOYSA-N
Compound name
2-[3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethynyl-trimethylsilane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.16226 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.16954 165.1
[M+Na]+ 341.15148 177.5
[M-H]- 317.15498 170.3
[M+NH4]+ 336.19608 182.4
[M+K]+ 357.12542 172.9
[M+H-H2O]+ 301.15952 154.1
[M+HCOO]- 363.16046 177.2
[M+CH3COO]- 377.17611 211.0
[M+Na-2H]- 339.13693 168.1
[M]+ 318.16171 162.5
[M]- 318.16281 162.5
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.