PubChemLite - Etfhxspeg, m=7 (C24H38F13NO10S)

Structural Information

Molecular Formula

SMILES

CCN(CCOCCOCCOCCOCCOCCOCCOCCO)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C24H38F13NO10S/c1-2-38(49(40,41)24(36,37)22(31,32)20(27,28)19(25,26)21(29,30)23(33,34)35)3-5-42-7-9-44-11-13-46-15-17-48-18-16-47-14-12-45-10-8-43-6-4-39/h39H,2-18H2,1H3

InChIKey

LHKVOTPYHHRKSY-UHFFFAOYSA-N

Compound name

N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-N-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]hexane-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]+	780.20815	232.8
[M+Na]+	802.19009	232.9
[M-H]-	778.19359	238.2
[M+NH4]+	797.23469	245.8
[M+K]+	818.16403	243.0
[M+H-H2O]+	762.19813	222.2
[M+HCOO]-	824.19907	244.5
[M+CH3COO]-	838.21472	278.3
[M+Na-2H]-	800.17554	221.6
[M]+	779.20032	234.8
[M]-	779.20142	234.8

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

780.20815

232.8

[M+Na]+

802.19009

232.9

[M-H]-

778.19359

238.2

[M+NH4]+

797.23469

245.8

[M+K]+

818.16403

243.0

[M+H-H2O]+

762.19813

222.2

[M+HCOO]-

824.19907

244.5

[M+CH3COO]-

838.21472

278.3

[M+Na-2H]-

800.17554

221.6

[M]+

779.20032

234.8

[M]-

779.20142

234.8

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

Etfhxspeg, m=7

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe