CID 55256102

2-(3,3,3-trifluoropropyl)-1,3-dioxolane

Structural Information

Molecular Formula
C6H9F3O2
SMILES
C1COC(O1)CCC(F)(F)F
InChI
InChI=1S/C6H9F3O2/c7-6(8,9)2-1-5-10-3-4-11-5/h5H,1-4H2
InChIKey
DPRUTITWLKDMID-UHFFFAOYSA-N
Compound name
2-(3,3,3-trifluoropropyl)-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.05547 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.06275 142.6
[M+Na]+ 193.04469 149.5
[M+NH4]+ 188.08929 148.2
[M+K]+ 209.01863 147.1
[M-H]- 169.04819 140.7
[M+Na-2H]- 191.03014 143.4
[M]+ 170.05492 142.7
[M]- 170.05602 142.7
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.