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]+ 178.11353 154.0
[M+Na]+ 200.09547 158.9
[M-H]- 176.09897 153.6
[M+NH4]+ 195.14007 160.3
[M+K]+ 216.06941 163.2
[M+H-H2O]+ 160.10351 142.4
[M+HCOO]- 222.10445 163.6
[M+CH3COO]- 236.12010 208.0
[M+Na-2H]- 198.08092 159.5
[M]+ 177.10570 174.1
[M]- 177.10680 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.