Dataset

2-ClPFPECA-0-2; LC-ESI-QFT; MS2; CE: 45%; R=17500; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ01166153 contains the MS2 mass spectrum of 2-ClPFPECA-0-2 with the InChIkey JGRBOYAJYKVCOB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11HClF20O5/c12-3(15,6(18,19)20)9(27,28)37-11(31,32)5(17,8(24,25)26)36-10(29,30)4(16,7(21,22)23)35-2(13,14)1(33)34/h(H,33,34)
SMILES C(=O)(C(OC(C(OC(C(OC(C(C(F)(F)F)(F)Cl)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)O
InChI Key JGRBOYAJYKVCOB-UHFFFAOYSA-N
Molecular Formula C11HClF20O5
Exact Mass 627.919 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-EQ01166153
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MetadataPublished 2024-05-15
Related Molecule
  • 2-[1-[1-(2-chloro-1,1,2,3,3,3-hexafluoropropoxy)-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
    102331873 pubchem
    The data in this table is sourced from UniChem at EBI.