CID 105427192

2-fluoro-2-(oxetan-3-yl)ethan-1-ol

Structural Information

Molecular Formula
C5H9FO2
SMILES
C1C(CO1)C(CO)F
InChI
InChI=1S/C5H9FO2/c6-5(1-7)4-2-8-3-4/h4-5,7H,1-3H2
InChIKey
VJKSEPCYNXUWSX-UHFFFAOYSA-N
Compound name
2-fluoro-2-(oxetan-3-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

120.058655 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.06593 119.0
[M+Na]+ 143.04787 124.2
[M-H]- 119.05138 120.5
[M+NH4]+ 138.09248 132.8
[M+K]+ 159.02181 128.2
[M+H-H2O]+ 103.05592 108.6
[M+HCOO]- 165.05686 137.5
[M+CH3COO]- 179.07251 170.6
[M+Na-2H]- 141.03332 125.2
[M]+ 120.05811 125.4
[M]- 120.05920 125.4
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.