CID 138991260

2375371-69-8

Structural Information

Molecular Formula
C7H13BF3
SMILES
[B-]([C@@H]1C[C@H]1C(C)(C)C)(F)(F)F
InChI
InChI=1S/C7H13BF3/c1-7(2,3)5-4-6(5)8(9,10)11/h5-6H,4H2,1-3H3/q-1/t5-,6-/m1/s1
InChIKey
KFECPCVBISKFLS-PHDIDXHHSA-N
Compound name
[(1R,2R)-2-tert-butylcyclopropyl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

165.10625 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.113526 126.0
[M+Na]+ 188.095468 135.7
[M-H]- 164.098974 125.7
[M+NH4]+ 183.140073 141.9
[M+K]+ 204.069408 133.6
[M+H-H2O]+ 148.103510 121.2
[M+HCOO]- 210.104451 143.0
[M+CH3COO]- 224.120101 181.3
[M+Na-2H]- 186.080916 131.4
[M]+ 165.10570142 122.7
[M]- 165.10679858 122.7
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.