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Octaaethylene glycol 2TFA
SpectraBase Compound ID 3q956p0NxJi
InChI InChI=1S/C20H32F6O11/c21-19(22,23)17(27)36-15-13-34-11-9-32-7-5-30-3-1-29-2-4-31-6-8-33-10-12-35-14-16-37-18(28)20(24,25)26/h1-16H2
InChIKey OUCQBZQZSJUTSF-UHFFFAOYSA-N
Mol Weight 562.5 g/mol
Molecular Formula C20H32F6O11
Exact Mass 562.184881 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEdASIXCxuK
Name Octaaethylene glycol 2TFA
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 562.184880817 u
Formula C20H32F6O11
InChI InChI=1S/C20H32F6O11/c21-19(22,23)17(27)36-15-13-34-11-9-32-7-5-30-3-1-29-2-4-31-6-8-33-10-12-35-14-16-37-18(28)20(24,25)26/h1-16H2
InChIKey OUCQBZQZSJUTSF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 562.455 g/mol
Nominal Mass 562 u
Quality 884
Retention Index 3864
SMILES C(C(OCCOCCOCCOCCOCCOCCOCCOCCOC(C(F)(F)F)=O)=O)(F)(F)F
SPLASH splash10-0006-5900000000-b17709e780ee26857590
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Octaaethylene glycol bis(trifluoroacetate) 26,26,26-trifluoro-25-oxo-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl trifluoroacetate
Technique GC/MS
Wiley ID DD2024_018305