Dataset

2-Clpfpeca-1-1; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ01166351 contains the MS2 mass spectrum of 2-Clpfpeca-1-1 with the InChIkey GEXXADHKKGBLLH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10HClF18O5/c11-3(14,5(16,17)18)8(25,26)33-10(29,7(22,23)24)34-9(27,28)4(15,6(19,20)21)32-2(12,13)1(30)31/h(H,30,31)
SMILES C(=O)(C(OC(C(OC(C(F)(F)F)(OC(C(C(F)(F)F)(F)Cl)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)O
InChI Key GEXXADHKKGBLLH-UHFFFAOYSA-N
Molecular Formula C10HClF18O5
Exact Mass 577.923 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01166351
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MetadataPublished 2024-05-15
Related Molecule
  • 2-[1-[1-(2-chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,2,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-2,2-difluoroacetic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    163325054 pubchem
    The data in this table is sourced from UniChem at EBI.