CID 155970839

Potassium [3-(chloromethyl)bicyclo[1.1.1]pentan-1-yl]trifluoroboranuide

Structural Information

Molecular Formula
C6H8BClF3
SMILES
[B-](C12CC(C1)(C2)CCl)(F)(F)F
InChI
InChI=1S/C6H8BClF3/c8-4-5-1-6(2-5,3-5)7(9,10)11/h1-4H2/q-1
InChIKey
MHRHTMZBMLQNBU-UHFFFAOYSA-N
Compound name
[3-(chloromethyl)-1-bicyclo[1.1.1]pentanyl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.03596 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.04324 146.4
[M+Na]+ 206.02518 143.6
[M+NH4]+ 201.06978 145.8
[M+K]+ 221.99912 141.5
[M-H]- 182.02868 137.2
[M+Na-2H]- 204.01063 142.7
[M]+ 183.03541 141.0
[M]- 183.03651 141.0
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.