CID 2782849

Potassium o-tolyltrifluoroborate

Structural Information

Molecular Formula
C7H7BF3
SMILES
[B-](C1=CC=CC=C1C)(F)(F)F
InChI
InChI=1S/C7H7BF3/c1-6-4-2-3-5-7(6)8(9,10)11/h2-5H,1H3/q-1
InChIKey
KIBCSSROSOYPJU-UHFFFAOYSA-N
Compound name
trifluoro-(2-methylphenyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.0593 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.06658 123.3
[M+Na]+ 182.04852 132.3
[M-H]- 158.05202 121.8
[M+NH4]+ 177.09312 143.8
[M+K]+ 198.02246 129.9
[M+H-H2O]+ 142.05656 118.4
[M+HCOO]- 204.05750 142.9
[M+CH3COO]- 218.07315 174.7
[M+Na-2H]- 180.03397 129.5
[M]+ 159.05875 116.8
[M]- 159.05985 116.8
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

patents stripe