CID 165920074

Potassium trifluoro[3-(oxan-4-yl)bicyclo[1.1.1]pentan-1-yl]boranuide

Structural Information

Molecular Formula
C10H15BF3O
SMILES
[B-](C12CC(C1)(C2)C3CCOCC3)(F)(F)F
InChI
InChI=1S/C10H15BF3O/c12-11(13,14)10-5-9(6-10,7-10)8-1-3-15-4-2-8/h8H,1-7H2/q-1
InChIKey
ITFLDHJOHBHNFS-UHFFFAOYSA-N
Compound name
trifluoro-[3-(oxan-4-yl)-1-bicyclo[1.1.1]pentanyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.1168 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.12408 149.6
[M+Na]+ 242.10602 152.7
[M-H]- 218.10952 151.1
[M+NH4]+ 237.15062 153.4
[M+K]+ 258.07996 158.3
[M+H-H2O]+ 202.11406 136.6
[M+HCOO]- 264.11500 156.5
[M+CH3COO]- 278.13065 211.1
[M+Na-2H]- 240.09147 155.6
[M]+ 219.11625 167.0
[M]- 219.11735 167.0
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.