CID 88542033

Potassium (acetoxymethyl)trifluoroborate

Structural Information

Molecular Formula
C3H5BF3O2
SMILES
[B-](COC(=O)C)(F)(F)F
InChI
InChI=1S/C3H5BF3O2/c1-3(8)9-2-4(5,6)7/h2H2,1H3/q-1
InChIKey
FSACASZVRHHAQX-UHFFFAOYSA-N
Compound name
acetyloxymethyl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

27
Patents

141.03346 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.04074 119.8
[M+Na]+ 164.02268 128.2
[M-H]- 140.02618 115.0
[M+NH4]+ 159.06728 140.8
[M+K]+ 179.99662 128.6
[M+H-H2O]+ 124.03072 116.0
[M+HCOO]- 186.03166 138.8
[M+CH3COO]- 200.04731 169.3
[M+Na-2H]- 162.00813 124.9
[M]+ 141.03291 115.2
[M]- 141.03401 115.2
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