CID 146049890

1-(bromomethyl)-1-(1,1-difluoroethyl)cyclobutane

Structural Information

Molecular Formula
C7H11BrF2
SMILES
CC(C1(CCC1)CBr)(F)F
InChI
InChI=1S/C7H11BrF2/c1-6(9,10)7(5-8)3-2-4-7/h2-5H2,1H3
InChIKey
IUEQDWMXGHNEKA-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-1-(1,1-difluoroethyl)cyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.00122 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.00850 148.5
[M+Na]+ 234.99044 145.7
[M+NH4]+ 230.03504 150.6
[M+K]+ 250.96438 145.5
[M-H]- 210.99394 143.7
[M+Na-2H]- 232.97589 148.5
[M]+ 212.00067 144.8
[M]- 212.00177 144.8
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.