Dataset

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

This MassBank record with Accession MSBNK-Eawag-EQ01145451 contains the MS2 mass spectrum of NFDHA with the InChIkey PPWRLPJIHGWGFH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C5HF9O4/c6-2(7,1(15)16)17-3(8,9)4(10,11)18-5(12,13)14/h(H,15,16)
SMILES C(=O)(C(OC(C(OC(F)(F)F)(F)F)(F)F)(F)F)O
InChI Key PPWRLPJIHGWGFH-UHFFFAOYSA-N
Molecular Formula C5HF9O4
Exact Mass 295.973 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01145451
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MetadataPublished 2024-05-15
Related Molecule
  • 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]acetic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    916729 surechembl
    2782393 pubchem
    PD213539 probes_and_drugs
    Molport-000-158-043 molport
    The data in this table is sourced from UniChem at EBI.