CID 165950412

Rac-(1r,2r)-1-bromo-2-(trifluoromethyl)cyclopropane

Structural Information

Molecular Formula
C4H4BrF3
SMILES
C1[C@H]([C@H]1Br)C(F)(F)F
InChI
InChI=1S/C4H4BrF3/c5-3-1-2(3)4(6,7)8/h2-3H,1H2/t2-,3+/m1/s1
InChIKey
UTBPILYWBNOGKM-GBXIJSLDSA-N
Compound name
(1S,2S)-1-bromo-2-(trifluoromethyl)cyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.94485 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.95213 136.5
[M+Na]+ 210.93407 137.7
[M+NH4]+ 205.97867 140.2
[M+K]+ 226.90801 139.6
[M-H]- 186.93757 137.7
[M+Na-2H]- 208.91952 139.2
[M]+ 187.94430 136.6
[M]- 187.94540 136.6
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.