CID 9798005

69807-91-6

Structural Information

Molecular Formula
C14H15BF6O2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C14H15BF6O2/c1-11(2)12(3,4)23-15(22-11)10-6-8(13(16,17)18)5-9(7-10)14(19,20)21/h5-7H,1-4H3
InChIKey
GGMXSSNJKVWXMD-UHFFFAOYSA-N
Compound name
2-[3,5-bis(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

340.10693 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.11421 165.6
[M+Na]+ 363.09615 176.9
[M-H]- 339.09965 167.1
[M+NH4]+ 358.14075 183.1
[M+K]+ 379.07009 175.6
[M+H-H2O]+ 323.10419 157.5
[M+HCOO]- 385.10513 176.8
[M+CH3COO]- 399.12078 209.4
[M+Na-2H]- 361.08160 169.5
[M]+ 340.10638 161.0
[M]- 340.10748 161.0
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