CID 10420368

166328-10-5

Structural Information

Molecular Formula
C6H4BF4
SMILES
[B-](C1=CC=CC=C1F)(F)(F)F
InChI
InChI=1S/C6H4BF4/c8-6-4-2-1-3-5(6)7(9,10)11/h1-4H/q-1
InChIKey
WDYIQJPWZQFULJ-UHFFFAOYSA-N
Compound name
trifluoro-(2-fluorophenyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.03423 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04151 121.2
[M+Na]+ 186.02345 130.6
[M-H]- 162.02695 118.4
[M+NH4]+ 181.06805 141.4
[M+K]+ 201.99739 128.1
[M+H-H2O]+ 146.03149 115.5
[M+HCOO]- 208.03243 140.0
[M+CH3COO]- 222.04808 174.6
[M+Na-2H]- 184.00890 127.4
[M]+ 163.03368 113.1
[M]- 163.03478 113.1
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.