CID 105439153

(2-bromo-1-fluoroethyl)cyclobutane

Structural Information

Molecular Formula
C6H10BrF
SMILES
C1CC(C1)C(CBr)F
InChI
InChI=1S/C6H10BrF/c7-4-6(8)5-2-1-3-5/h5-6H,1-4H2
InChIKey
UDFXKDIUSIJDSS-UHFFFAOYSA-N
Compound name
(2-bromo-1-fluoroethyl)cyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.995 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.00228 125.5
[M+Na]+ 202.98422 134.6
[M-H]- 178.98772 130.3
[M+NH4]+ 198.02882 143.0
[M+K]+ 218.95816 127.9
[M+H-H2O]+ 162.99226 121.2
[M+HCOO]- 224.99320 143.7
[M+CH3COO]- 239.00885 183.0
[M+Na-2H]- 200.96967 132.2
[M]+ 179.99445 148.4
[M]- 179.99555 148.4
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.