CID 2782865

Potassium (3-chloro-4-fluorophenyl)trifluoroborate

Structural Information

Molecular Formula
C6H3BClF4
SMILES
[B-](C1=CC(=C(C=C1)F)Cl)(F)(F)F
InChI
InChI=1S/C6H3BClF4/c8-5-3-4(7(10,11)12)1-2-6(5)9/h1-3H/q-1
InChIKey
AUPZUZNROOOZRK-UHFFFAOYSA-N
Compound name
(3-chloro-4-fluorophenyl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.99524 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.00252 126.6
[M+Na]+ 219.98446 137.6
[M-H]- 195.98796 123.9
[M+NH4]+ 215.02906 146.6
[M+K]+ 235.95840 133.1
[M+H-H2O]+ 179.99250 121.9
[M+HCOO]- 241.99344 140.9
[M+CH3COO]- 256.00909 179.6
[M+Na-2H]- 217.96991 131.7
[M]+ 196.99469 121.0
[M]- 196.99579 121.0
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.