CID 105427138

2-cyclobutyl-2-fluoroethan-1-ol

Structural Information

Molecular Formula
C6H11FO
SMILES
C1CC(C1)C(CO)F
InChI
InChI=1S/C6H11FO/c7-6(4-8)5-2-1-3-5/h5-6,8H,1-4H2
InChIKey
MXTXZSFKKWPQLV-UHFFFAOYSA-N
Compound name
2-cyclobutyl-2-fluoroethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

118.07939 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.08667 122.5
[M+Na]+ 141.06861 127.5
[M-H]- 117.07211 123.3
[M+NH4]+ 136.11321 137.7
[M+K]+ 157.04255 129.8
[M+H-H2O]+ 101.07665 112.2
[M+HCOO]- 163.07759 141.4
[M+CH3COO]- 177.09324 171.8
[M+Na-2H]- 139.05406 127.0
[M]+ 118.07884 127.3
[M]- 118.07994 127.3
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.