CID 16217318

Potassium 2-bromophenyltrifluoroborate

Structural Information

Molecular Formula
C6H4BBrF3
SMILES
[B-](C1=CC=CC=C1Br)(F)(F)F
InChI
InChI=1S/C6H4BBrF3/c8-6-4-2-1-3-5(6)7(9,10)11/h1-4H/q-1
InChIKey
BADAICVFNZBPNU-UHFFFAOYSA-N
Compound name
(2-bromophenyl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

222.95415 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.96143 136.3
[M+Na]+ 245.94337 148.9
[M-H]- 221.94687 137.8
[M+NH4]+ 240.98797 157.8
[M+K]+ 261.91731 137.6
[M+H-H2O]+ 205.95141 137.3
[M+HCOO]- 267.95235 154.0
[M+CH3COO]- 281.96800 182.3
[M+Na-2H]- 243.92882 143.5
[M]+ 222.95360 148.7
[M]- 222.95470 148.7
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.