CID 165588495

Potassium [1-(2-ethoxy-2-oxoethyl)cyclopropyl]trifluoroboranuide

Structural Information

Molecular Formula
C7H11BF3O2
SMILES
[B-](C1(CC1)CC(=O)OCC)(F)(F)F
InChI
InChI=1S/C7H11BF3O2/c1-2-13-6(12)5-7(3-4-7)8(9,10)11/h2-5H2,1H3/q-1
InChIKey
SSDAOHBSABYQRI-UHFFFAOYSA-N
Compound name
[1-(2-ethoxy-2-oxoethyl)cyclopropyl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.08041 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.087686 134.0
[M+Na]+ 218.069628 143.0
[M-H]- 194.073134 133.3
[M+NH4]+ 213.114233 149.9
[M+K]+ 234.043568 141.8
[M+H-H2O]+ 178.077670 129.4
[M+HCOO]- 240.078611 151.7
[M+CH3COO]- 254.094261 182.8
[M+Na-2H]- 216.055076 138.9
[M]+ 195.07986142 132.7
[M]- 195.08095858 132.7
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.