CID 57988815

5,5-difluoro-1-oxaspiro[2.3]hexane

Structural Information

Molecular Formula
C5H6F2O
SMILES
C1C2(CC1(F)F)CO2
InChI
InChI=1S/C5H6F2O/c6-5(7)1-4(2-5)3-8-4/h1-3H2
InChIKey
RNALRSYAWLFJMF-UHFFFAOYSA-N
Compound name
5,5-difluoro-1-oxaspiro[2.3]hexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

120.03867 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.04595 129.8
[M+Na]+ 143.02789 136.7
[M+NH4]+ 138.07249 137.2
[M+K]+ 159.00183 131.8
[M-H]- 119.03139 134.5
[M+Na-2H]- 141.01334 136.6
[M]+ 120.03812 132.3
[M]- 120.03922 132.3
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

patents stripe