CID 138396500

Dtxsid80896746

Structural Information

Molecular Formula
C10F22O4
SMILES
C(C(F)(F)F)(C(F)(F)F)(OC(C(OC(C(F)(F)F)(C(F)(F)F)OC(F)(F)F)(F)F)(F)F)OC(F)(F)F
InChI
InChI=1S/C10F22O4/c11-3(12,13)1(4(14,15)16,35-9(27,28)29)33-7(23,24)8(25,26)34-2(5(17,18)19,6(20,21)22)36-10(30,31)32
InChIKey
HTIKFKFFFZPLCK-UHFFFAOYSA-N
Compound name
1,1,1,3,3,3-hexafluoro-2-[1,1,2,2-tetrafluoro-2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethoxy)propan-2-yl]oxyethoxy]-2-(trifluoromethoxy)propane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

601.9445 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 602.95178 171.9
[M+Na]+ 624.93372 175.7
[M-H]- 600.93722 182.1
[M+NH4]+ 619.97832 184.0
[M+K]+ 640.90766 186.1
[M+H-H2O]+ 584.94176 160.7
[M+HCOO]- 646.94270 192.3
[M+CH3COO]- 660.95835 247.1
[M+Na-2H]- 622.91917 172.9
[M]+ 601.94395 170.5
[M]- 601.94505 170.5
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.