CID 83670248

3-fluorooxan-4-ol

Structural Information

Molecular Formula
C5H9FO2
SMILES
C1COCC(C1O)F
InChI
InChI=1S/C5H9FO2/c6-4-3-8-2-1-5(4)7/h4-5,7H,1-3H2
InChIKey
MSXRZCAECMOKSR-UHFFFAOYSA-N
Compound name
3-fluorooxan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

120.058655 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.065931 120.4
[M+Na]+ 143.047873 126.9
[M-H]- 119.051379 121.8
[M+NH4]+ 138.092478 140.8
[M+K]+ 159.021813 127.4
[M+H-H2O]+ 103.055915 114.9
[M+HCOO]- 165.056856 138.9
[M+CH3COO]- 179.072506 165.4
[M+Na-2H]- 141.033321 127.1
[M]+ 120.05810642 115.4
[M]- 120.05920358 115.4
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

patents stripe