CID 139597400

Etfospeg, m=9

Structural Information

Molecular Formula
C30H46F17NO12S
SMILES
CCN(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)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/C30H46F17NO12S/c1-2-48(61(50,51)30(46,47)28(41,42)26(37,38)24(33,34)23(31,32)25(35,36)27(39,40)29(43,44)45)3-5-52-7-9-54-11-13-56-15-17-58-19-21-60-22-20-59-18-16-57-14-12-55-10-8-53-6-4-49/h49H,2-22H2,1H3
InChIKey
UXWLFCCFIPXSRE-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-(2-hydroxyethoxy)ethoxy]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

967.24695 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 968.25423 157.0
[M+Na]+ 990.23617 157.1
[M+NH4]+ 985.28077 157.2
[M+K]+ 1006.2101 157.2
[M-H]- 966.23967 157.0
[M+Na-2H]- 988.22162 156.7
[M]+ 967.24640 157.1
[M]- 967.24750 157.1
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.