CID 105448661

(2-bromo-1-fluoroethyl)cyclopentane

Structural Information

Molecular Formula
C7H12BrF
SMILES
C1CCC(C1)C(CBr)F
InChI
InChI=1S/C7H12BrF/c8-5-7(9)6-3-1-2-4-6/h6-7H,1-5H2
InChIKey
DAFVISKPUVFIIE-UHFFFAOYSA-N
Compound name
(2-bromo-1-fluoroethyl)cyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.01064 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.01792 141.4
[M+Na]+ 216.99986 150.9
[M-H]- 193.00336 145.7
[M+NH4]+ 212.04446 165.7
[M+K]+ 232.97380 141.0
[M+H-H2O]+ 177.00790 141.2
[M+HCOO]- 239.00884 159.9
[M+CH3COO]- 253.02449 180.7
[M+Na-2H]- 214.98531 145.1
[M]+ 194.01009 155.2
[M]- 194.01119 155.2
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.