CID 2782883

Potassium m-tolyltrifluoroborate

Structural Information

Molecular Formula
C7H7BF3
SMILES
[B-](C1=CC(=CC=C1)C)(F)(F)F
InChI
InChI=1S/C7H7BF3/c1-6-3-2-4-7(5-6)8(9,10)11/h2-5H,1H3/q-1
InChIKey
GYUZPPWNWNKGSJ-UHFFFAOYSA-N
Compound name
trifluoro-(3-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]+ 160.066576 123.3
[M+Na]+ 182.048518 132.3
[M-H]- 158.052024 121.8
[M+NH4]+ 177.093123 143.8
[M+K]+ 198.022458 129.9
[M+H-H2O]+ 142.056560 118.4
[M+HCOO]- 204.057501 142.9
[M+CH3COO]- 218.073151 174.7
[M+Na-2H]- 180.033966 129.5
[M]+ 159.05875142 116.8
[M]- 159.05984858 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

No patent data available for this compound.