CID 44717657

1150655-12-1

Structural Information

Molecular Formula
C7H3BF7
SMILES
[B-](C1=C(C=C(C=C1)C(F)(F)F)F)(F)(F)F
InChI
InChI=1S/C7H3BF7/c9-6-3-4(7(10,11)12)1-2-5(6)8(13,14)15/h1-3H/q-1
InChIKey
ZGRKYGWPVXHPGV-UHFFFAOYSA-N
Compound name
trifluoro-[2-fluoro-4-(trifluoromethyl)phenyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.0216 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.02888 162.1
[M+Na]+ 254.01082 166.6
[M+NH4]+ 249.05542 163.9
[M+K]+ 269.98476 163.2
[M-H]- 230.01432 155.4
[M+Na-2H]- 251.99627 162.3
[M]+ 231.02105 160.4
[M]- 231.02215 160.4
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.