CID 11447320

267006-26-8

Structural Information

Molecular Formula
C6H3BF5
SMILES
[B-](C1=CC(=CC(=C1)F)F)(F)(F)F
InChI
InChI=1S/C6H3BF5/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H/q-1
InChIKey
RLRUBKPJKUNMFS-UHFFFAOYSA-N
Compound name
(3,5-difluorophenyl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.0248 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.032076 123.5
[M+Na]+ 204.014018 133.9
[M-H]- 180.017524 119.8
[M+NH4]+ 199.058623 143.2
[M+K]+ 219.987958 130.9
[M+H-H2O]+ 164.022060 117.0
[M+HCOO]- 226.023001 141.2
[M+CH3COO]- 240.038651 178.7
[M+Na-2H]- 201.999466 128.4
[M]+ 181.02425142 114.5
[M]- 181.02534858 114.5
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.