CID 80604390

2,2-difluoro-1-(oxolan-3-yl)ethan-1-ol

Structural Information

Molecular Formula
C6H10F2O2
SMILES
C1COCC1C(C(F)F)O
InChI
InChI=1S/C6H10F2O2/c7-6(8)5(9)4-1-2-10-3-4/h4-6,9H,1-3H2
InChIKey
VVYCCBMCOAPDKF-UHFFFAOYSA-N
Compound name
2,2-difluoro-1-(oxolan-3-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.06488 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.072156 129.6
[M+Na]+ 175.054098 135.1
[M-H]- 151.057604 129.2
[M+NH4]+ 170.098703 150.0
[M+K]+ 191.028038 135.6
[M+H-H2O]+ 135.062140 123.1
[M+HCOO]- 197.063081 146.7
[M+CH3COO]- 211.078731 171.6
[M+Na-2H]- 173.039546 131.9
[M]+ 152.06433142 124.0
[M]- 152.06542858 124.0
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.