CID 155823321

Potassium trifluoro({3-propylbicyclo[1.1.1]pentan-1-yl})boranuide

Structural Information

Molecular Formula
C8H13BF3
SMILES
[B-](C12CC(C1)(C2)CCC)(F)(F)F
InChI
InChI=1S/C8H13BF3/c1-2-3-7-4-8(5-7,6-7)9(10,11)12/h2-6H2,1H3/q-1
InChIKey
LXHPCAUYUFXRSK-UHFFFAOYSA-N
Compound name
trifluoro-(3-propyl-1-bicyclo[1.1.1]pentanyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.10625 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.113526 154.0
[M+Na]+ 200.095468 158.9
[M-H]- 176.098974 153.6
[M+NH4]+ 195.140073 160.3
[M+K]+ 216.069408 163.2
[M+H-H2O]+ 160.103510 142.4
[M+HCOO]- 222.104451 163.6
[M+CH3COO]- 236.120101 208.0
[M+Na-2H]- 198.080916 159.5
[M]+ 177.10570142 174.1
[M]- 177.10679858 174.1
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.