CID 155970791

En300-26871716

Structural Information

Molecular Formula
C7H9BF5
SMILES
[B-](CC1CC2C(C1)C2(F)F)(F)(F)F
InChI
InChI=1S/C7H9BF5/c9-7(10)5-1-4(2-6(5)7)3-8(11,12)13/h4-6H,1-3H2/q-1
InChIKey
LHRHOEHTCASTKB-UHFFFAOYSA-N
Compound name
(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methyl-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.07175 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.07903 127.6
[M+Na]+ 222.06097 138.6
[M-H]- 198.06447 125.4
[M+NH4]+ 217.10557 146.2
[M+K]+ 238.03491 135.1
[M+H-H2O]+ 182.06901 122.0
[M+HCOO]- 244.06995 142.4
[M+CH3COO]- 258.08560 185.4
[M+Na-2H]- 220.04642 131.5
[M]+ 199.07120 121.3
[M]- 199.07230 121.3
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.