CID 131967175

2-[[2,2,4-trifluoro-5-(trifluoromethoxy)-1,3-dioxolan-4-yl]oxy]ethanol

Structural Information

Molecular Formula
C6H6F6O5
SMILES
C(COC1(C(OC(O1)(F)F)OC(F)(F)F)F)O
InChI
InChI=1S/C6H6F6O5/c7-4(14-2-1-13)3(15-5(8,9)10)16-6(11,12)17-4/h3,13H,1-2H2
InChIKey
SQIJEOXNTYSYRD-UHFFFAOYSA-N
Compound name
2-[[2,2,4-trifluoro-5-(trifluoromethoxy)-1,3-dioxolan-4-yl]oxy]ethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

272.01193 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.01921 141.3
[M+Na]+ 295.00115 151.5
[M-H]- 271.00465 137.7
[M+NH4]+ 290.04575 159.9
[M+K]+ 310.97509 152.7
[M+H-H2O]+ 255.00919 134.4
[M+HCOO]- 317.01013 154.4
[M+CH3COO]- 331.02578 189.3
[M+Na-2H]- 292.98660 148.1
[M]+ 272.01138 138.2
[M]- 272.01248 138.2
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