CID 139595734

Etfospeg, m=8

Structural Information

Molecular Formula
C28H42F17NO11S
SMILES
CCN(CCOCCOCCOCCOCCOCCOCCOCCOCCO)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C28H42F17NO11S/c1-2-46(3-5-50-7-9-52-11-13-54-15-17-56-19-20-57-18-16-55-14-12-53-10-8-51-6-4-47)58(48,49)28(44,45)26(39,40)24(35,36)22(31,32)21(29,30)23(33,34)25(37,38)27(41,42)43/h47H,2-20H2,1H3
InChIKey
KHODLRGIHGQGFK-UHFFFAOYSA-N
Compound name
N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]octane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

923.2207 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 924.22798 156.8
[M+Na]+ 946.20992 156.9
[M+NH4]+ 941.25452 157.0
[M+K]+ 962.18386 157.0
[M-H]- 922.21342 156.8
[M+Na-2H]- 944.19537 156.6
[M]+ 923.22015 156.9
[M]- 923.22125 156.9
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.