CID 155645570

2562305-73-9

Structural Information

Molecular Formula
C16H24BFO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(C=C(C=C2)C(C)(C)C)F
InChI
InChI=1S/C16H24BFO2/c1-14(2,3)11-8-9-12(13(18)10-11)17-19-15(4,5)16(6,7)20-17/h8-10H,1-7H3
InChIKey
PSSHTHAIKBKVPL-UHFFFAOYSA-N
Compound name
2-(4-tert-butyl-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

278.18533 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.19261 158.1
[M+Na]+ 301.17455 168.0
[M-H]- 277.17805 165.9
[M+NH4]+ 296.21915 178.6
[M+K]+ 317.14849 167.8
[M+H-H2O]+ 261.18259 153.8
[M+HCOO]- 323.18353 175.7
[M+CH3COO]- 337.19918 201.6
[M+Na-2H]- 299.16000 163.1
[M]+ 278.18478 161.2
[M]- 278.18588 161.2
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