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]+ 196.08769 134.0
[M+Na]+ 218.06963 143.0
[M-H]- 194.07313 133.3
[M+NH4]+ 213.11423 149.9
[M+K]+ 234.04357 141.8
[M+H-H2O]+ 178.07767 129.4
[M+HCOO]- 240.07861 151.7
[M+CH3COO]- 254.09426 182.8
[M+Na-2H]- 216.05508 138.9
[M]+ 195.07986 132.7
[M]- 195.08096 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.