CID 162396554

Dona-cf2

Structural Information

Molecular Formula
C6H2F10O4
SMILES
C(C(=O)O)(OC(C(C(OC(F)(F)F)(F)F)(F)F)(F)F)F
InChI
InChI=1S/C6H2F10O4/c7-1(2(17)18)19-4(10,11)3(8,9)5(12,13)20-6(14,15)16/h1H,(H,17,18)
InChIKey
NHXHIJIMSICWIR-UHFFFAOYSA-N
Compound name
2-fluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.97934 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.98662 185.5
[M+Na]+ 350.96856 185.3
[M+NH4]+ 346.01316 184.0
[M+K]+ 366.94250 183.8
[M-H]- 326.97206 177.3
[M+Na-2H]- 348.95401 181.8
[M]+ 327.97879 182.7
[M]- 327.97989 182.7
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.