CID 146155134

Rac-potassium [(1r,2s)-3,3-difluoro-[1,1'-bi(cyclopropane)]-2-yl]trifluoroboranuide

Structural Information

Molecular Formula
C6H7BF5
SMILES
[B-]([C@@H]1[C@H](C1(F)F)C2CC2)(F)(F)F
InChI
InChI=1S/C6H7BF5/c8-6(9)4(3-1-2-3)5(6)7(10,11)12/h3-5H,1-2H2/q-1/t4-,5-/m1/s1
InChIKey
KUTILDISBKENFV-RFZPGFLSSA-N
Compound name
[(1R,3S)-3-cyclopropyl-2,2-difluorocyclopropyl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.05609 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.06337 140.9
[M+Na]+ 208.04531 145.3
[M+NH4]+ 203.08991 145.2
[M+K]+ 224.01925 145.4
[M-H]- 184.04881 145.3
[M+Na-2H]- 206.03076 146.1
[M]+ 185.05554 143.6
[M]- 185.05664 143.6
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.