CID 165362507

Dtxsid501348676

Structural Information

Molecular Formula
C8H4F15NO2S
SMILES
C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)N
InChI
InChI=1S/C8H4F15NO2S/c9-2(10,1-27(24,25)26)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h1H2,(H2,24,25,26)
InChIKey
WXBBNQFZIVWCAJ-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

462.97232 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 463.979596 156.8
[M+Na]+ 485.961538 162.5
[M-H]- 461.965044 163.2
[M+NH4]+ 481.006143 164.2
[M+K]+ 501.935478 185.8
[M+H-H2O]+ 445.969580 166.3
[M+HCOO]- 507.970521 176.9
[M+CH3COO]- 521.986171 229.1
[M+Na-2H]- 483.946986 184.5
[M]+ 462.97177142 156.3
[M]- 462.97286858 156.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.