PubChemLite - Etfospeg, m=6 (C24H34F17NO9S)

Structural Information

Molecular Formula

SMILES

CCN(CCOCCOCCOCCOCCOCCOCCO)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/C24H34F17NO9S/c1-2-42(3-5-46-7-9-48-11-13-50-15-16-51-14-12-49-10-8-47-6-4-43)52(44,45)24(40,41)22(35,36)20(31,32)18(27,28)17(25,26)19(29,30)21(33,34)23(37,38)39/h43H,2-16H2,1H3

InChIKey

WGTGZLJXJVFIKO-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-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]octane-1-sulfonamide

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	836.17558	233.4
[M+Na]+	858.15752	233.3
[M-H]-	834.16102	241.9
[M+NH4]+	853.20212	247.5
[M+K]+	874.13146	246.6
[M+H-H2O]+	818.16556	220.5
[M+HCOO]-	880.16650	245.3
[M+CH3COO]-	894.18215	283.4
[M+Na-2H]-	856.14297	224.5
[M]+	835.16775	235.6
[M]-	835.16885	235.6

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

836.17558

233.4

[M+Na]+

858.15752

233.3

[M-H]-

834.16102

241.9

[M+NH4]+

853.20212

247.5

[M+K]+

874.13146

246.6

[M+H-H2O]+

818.16556

220.5

[M+HCOO]-

880.16650

245.3

[M+CH3COO]-

894.18215

283.4

[M+Na-2H]-

856.14297

224.5

[M]+

835.16775

235.6

[M]-

835.16885

235.6

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Etfospeg, m=6

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe