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]+ 150.08222 120.0
[M+Na]+ 172.06416 128.7
[M-H]- 148.06766 121.8
[M+NH4]+ 167.10876 132.3
[M+K]+ 188.03810 129.9
[M+H-H2O]+ 132.07220 111.5
[M+HCOO]- 194.07314 137.1
[M+CH3COO]- 208.08879 179.1
[M+Na-2H]- 170.04961 126.9
[M]+ 149.07439 123.3
[M]- 149.07549 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.