CID 109197

68156-06-9

Structural Information

Molecular Formula
C8F16O2S
SMILES
C1(C(C(C(C(C1(F)F)(F)F)(F)S(=O)(=O)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)F
InChI
InChI=1S/C8F16O2S/c9-1(4(14,15)8(21,22)23)2(10,11)5(16,17)7(20,27(24,25)26)6(18,19)3(1,12)13
InChIKey
ZUNLKLHLASQCRH-UHFFFAOYSA-N
Compound name
1,2,2,3,3,4,5,5,6,6-decafluoro-4-(1,1,2,2,2-pentafluoroethyl)cyclohexane-1-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

463.93634 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 464.94362 165.8
[M+Na]+ 486.92556 165.9
[M+NH4]+ 481.97016 165.8
[M+K]+ 502.89950 165.3
[M-H]- 462.92906 163.9
[M+Na-2H]- 484.91101 166.1
[M]+ 463.93579 165.3
[M]- 463.93689 165.3
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