CID 2760805

4-(trifluorovinyloxyphenyl)boronic acid

Structural Information

Molecular Formula
C8H6BF3O3
SMILES
B(C1=CC=C(C=C1)OC(=C(F)F)F)(O)O
InChI
InChI=1S/C8H6BF3O3/c10-7(11)8(12)15-6-3-1-5(2-4-6)9(13)14/h1-4,13-14H
InChIKey
MLZDWIPSGNEJKY-UHFFFAOYSA-N
Compound name
[4-(1,2,2-trifluoroethenoxy)phenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

218.03621 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.04349 146.7
[M+Na]+ 241.02543 154.1
[M+NH4]+ 236.07003 150.9
[M+K]+ 256.99937 150.9
[M-H]- 217.02893 142.0
[M+Na-2H]- 239.01088 148.7
[M]+ 218.03566 145.8
[M]- 218.03676 145.8
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