CID 11148797

664364-89-0

Structural Information

Molecular Formula
C9H9BF3
SMILES
[B-]([C@@H]1C[C@H]1C2=CC=CC=C2)(F)(F)F
InChI
InChI=1S/C9H9BF3/c11-10(12,13)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2/q-1/t8-,9+/m0/s1
InChIKey
KMISGGRORWMRRI-DTWKUNHWSA-N
Compound name
trifluoro-[(1R,2R)-2-phenylcyclopropyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.07494 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.08222 146.0
[M+Na]+ 208.06416 156.0
[M+NH4]+ 203.10876 152.7
[M+K]+ 224.03810 152.3
[M-H]- 184.06766 150.6
[M+Na-2H]- 206.04961 152.8
[M]+ 185.07439 149.2
[M]- 185.07549 149.2
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.