CID 67635

335-71-7

Structural Information

Molecular Formula
C7F16O2S
SMILES
C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7F16O2S/c8-1(9,2(10,11)4(14,15)6(18,19)20)3(12,13)5(16,17)7(21,22)26(23,24)25
InChIKey
FBIOXUYLJVKPPG-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane-1-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

451.93634 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 452.94362 166.7
[M+Na]+ 474.92556 166.7
[M+NH4]+ 469.97016 166.3
[M+K]+ 490.89950 166.5
[M-H]- 450.92906 164.6
[M+Na-2H]- 472.91101 166.4
[M]+ 451.93579 166.0
[M]- 451.93689 166.0
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