CID 165693662

Potassium trifluoro({3-oxospiro[3.3]heptan-1-yl})boranuide

Structural Information

Molecular Formula
C7H9BF3O
SMILES
[B-](C1CC(=O)C12CCC2)(F)(F)F
InChI
InChI=1S/C7H9BF3O/c9-8(10,11)5-4-6(12)7(5)2-1-3-7/h5H,1-4H2/q-1
InChIKey
PEPTZUIRKKXRKB-UHFFFAOYSA-N
Compound name
trifluoro-(3-oxospiro[3.3]heptan-1-yl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.06985 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.07713 124.2
[M+Na]+ 200.05907 130.2
[M-H]- 176.06257 125.2
[M+NH4]+ 195.10367 133.0
[M+K]+ 216.03301 133.7
[M+H-H2O]+ 160.06711 112.5
[M+HCOO]- 222.06805 138.7
[M+CH3COO]- 236.08370 189.6
[M+Na-2H]- 198.04452 129.1
[M]+ 177.06930 133.4
[M]- 177.07040 133.4
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.