CID 119030523

Potassium [(4,4-difluorocyclohexyl)methyl]trifluoroboranuide

Structural Information

Molecular Formula
C7H11BF5
SMILES
[B-](CC1CCC(CC1)(F)F)(F)(F)F
InChI
InChI=1S/C7H11BF5/c9-7(10)3-1-6(2-4-7)5-8(11,12)13/h6H,1-5H2/q-1
InChIKey
PMHZSCWQAPXOAX-UHFFFAOYSA-N
Compound name
(4,4-difluorocyclohexyl)methyl-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.0874 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.09468 135.5
[M+Na]+ 224.07662 142.4
[M-H]- 200.08012 130.5
[M+NH4]+ 219.12122 155.8
[M+K]+ 240.05056 140.1
[M+H-H2O]+ 184.08466 129.5
[M+HCOO]- 246.08560 148.6
[M+CH3COO]- 260.10125 181.3
[M+Na-2H]- 222.06207 138.5
[M]+ 201.08685 122.4
[M]- 201.08795 122.4
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.