CID 63701738

Potassium trifluoro(4-(trifluoromethyl)benzyl)borate

Structural Information

Molecular Formula
C8H6BF6
SMILES
[B-](CC1=CC=C(C=C1)C(F)(F)F)(F)(F)F
InChI
InChI=1S/C8H6BF6/c10-8(11,12)7-3-1-6(2-4-7)5-9(13,14)15/h1-4H,5H2/q-1
InChIKey
OTKKQUQNMBDWSG-UHFFFAOYSA-N
Compound name
trifluoro-[[4-(trifluoromethyl)phenyl]methyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.04668 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.05396 157.5
[M+Na]+ 250.03590 162.9
[M+NH4]+ 245.08050 160.2
[M+K]+ 266.00984 159.1
[M-H]- 226.03940 151.2
[M+Na-2H]- 248.02135 158.6
[M]+ 227.04613 156.0
[M]- 227.04723 156.0
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.