Dataset

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

This MassBank record with Accession MSBNK-Eawag-EQ01144451 contains the MS2 mass spectrum of PFPrA with the InChIkey LRMSQVBRUNSOJL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C3HF5O2/c4-2(5,1(9)10)3(6,7)8/h(H,9,10)
SMILES C(=O)(C(C(F)(F)F)(F)F)O
InChI Key LRMSQVBRUNSOJL-UHFFFAOYSA-N
Molecular Formula C3HF5O2
Exact Mass 163.990 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-EQ01144451
Version
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Maintainer
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MetadataPublished 2024-05-15
Related Molecule
  • 2,2,3,3,3-pentafluoropropanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    YWK rcsb_pdb
    63977 surechembl
    62356 pubchem
    QB53AX6MW4 fdasrs
    YWK - Ideal conformer pdbe
    HMDB0256333 hmdb
    The data in this table is sourced from UniChem at EBI.