Dataset

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

This MassBank record with Accession MSBNK-Eawag-EQ01166451 contains the MS2 mass spectrum of 2-ClPFPECA-1-2 with the InChIkey WSUKXTDODKPVPK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C13HClF24O6/c14-3(17,6(20,21)22)10(32,33)43-13(38,9(29,30)31)44-12(36,37)5(19,8(26,27)28)42-11(34,35)4(18,7(23,24)25)41-2(15,16)1(39)40/h(H,39,40)
SMILES C(=O)(C(OC(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)(C(F)(F)F)F)(F)F)O
InChI Key WSUKXTDODKPVPK-UHFFFAOYSA-N
Molecular Formula C13HClF24O6
Exact Mass 743.908 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-EQ01166451
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MetadataPublished 2024-05-15
Related Molecule
  • 2-[1-[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-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
    163325035 pubchem
    The data in this table is sourced from UniChem at EBI.