CID 154814214

Rac-(1r,2s)-1-(bromomethyl)-1-fluoro-2-methylcyclopropane

Structural Information

Molecular Formula
C5H8BrF
SMILES
C[C@@H]1C[C@]1(CBr)F
InChI
InChI=1S/C5H8BrF/c1-4-2-5(4,7)3-6/h4H,2-3H2,1H3/t4-,5-/m1/s1
InChIKey
FXTOEXOMBFTSPD-RFZPGFLSSA-N
Compound name
cis-(1S,2R)-1-(bromomethyl)-1-fluoro-2-methylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.97934 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.986616 125.4
[M+Na]+ 188.968558 139.8
[M-H]- 164.972064 132.2
[M+NH4]+ 184.013163 147.0
[M+K]+ 204.942498 129.9
[M+H-H2O]+ 148.976600 126.0
[M+HCOO]- 210.977541 146.2
[M+CH3COO]- 224.993191 180.6
[M+Na-2H]- 186.954006 134.4
[M]+ 165.97879142 144.7
[M]- 165.97988858 144.7
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.