CID 138991508

2542181-71-3

Structural Information

Molecular Formula
C6H9BF3
SMILES
[B-](C1CC12CCC2)(F)(F)F
InChI
InChI=1S/C6H9BF3/c8-7(9,10)5-4-6(5)2-1-3-6/h5H,1-4H2/q-1
InChIKey
IQJPCSVPKVKDCA-UHFFFAOYSA-N
Compound name
trifluoro(spiro[2.3]hexan-2-yl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.07494 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.082216 120.0
[M+Na]+ 172.064158 128.7
[M-H]- 148.067664 121.8
[M+NH4]+ 167.108763 132.3
[M+K]+ 188.038098 129.9
[M+H-H2O]+ 132.072200 111.5
[M+HCOO]- 194.073141 137.1
[M+CH3COO]- 208.088791 179.1
[M+Na-2H]- 170.049606 126.9
[M]+ 149.07439142 123.3
[M]- 149.07548858 123.3
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.