PubChemLite - Hopas n=3 m=10 (C26H41F13O10)

Structural Information

Molecular Formula

SMILES

C(COCCOCCOCCOCCOCCOCCOCCOCCOCCO)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C26H41F13O10/c27-21(28,22(29,30)23(31,32)24(33,34)25(35,36)26(37,38)39)1-3-41-5-7-43-9-11-45-13-15-47-17-19-49-20-18-48-16-14-46-12-10-44-8-6-42-4-2-40/h40H,1-20H2

InChIKey

FXZSYNXDEDCXIS-UHFFFAOYSA-N

Compound name

2-[2-[2-[2-[2-[2-[2-[2-[2-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

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]+	761.25648	227.2
[M+Na]+	783.23842	225.8
[M-H]-	759.24192	227.9
[M+NH4]+	778.28302	236.8
[M+K]+	799.21236	235.5
[M+H-H2O]+	743.24646	217.4
[M+HCOO]-	805.24740	240.2
[M+CH3COO]-	819.26305	274.7
[M+Na-2H]-	781.22387	214.8
[M]+	760.24865	226.8
[M]-	760.24975	226.8

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

761.25648

227.2

[M+Na]+

783.23842

225.8

[M-H]-

759.24192

227.9

[M+NH4]+

778.28302

236.8

[M+K]+

799.21236

235.5

[M+H-H2O]+

743.24646

217.4

[M+HCOO]-

805.24740

240.2

[M+CH3COO]-

819.26305

274.7

[M+Na-2H]-

781.22387

214.8

[M]+

760.24865

226.8

[M]-

760.24975

226.8

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

Hopas n=3 m=10

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe