Dataset

PF369TrOxTrDA; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ01146051 contains the MS2 mass spectrum of PF369TrOxTrDA with the InChIkey GDQLSTSWOFAQNO-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10HF19O5/c11-2(12,1(30)31)32-7(22,23)8(24,25)34-10(28,29)9(26,27)33-6(20,21)4(15,16)3(13,14)5(17,18)19/h(H,30,31)
SMILES C(=O)(C(OC(C(OC(C(OC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
InChI Key GDQLSTSWOFAQNO-UHFFFAOYSA-N
Molecular Formula C10HF19O5
Exact Mass 561.952 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-EQ01146051
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MetadataPublished 2024-05-15
Related Molecule
  • 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)ethoxy]ethoxy]acetic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    330562-41-9 ACToR
    911707 eMolecules
    2760333 PubChem
    SCHEMBL915267 SureChEMBL
    ZINC000095697014 ZINC
    DTXSID50375114 EPA CompTox Dashboard
    J3.416.496G Nikkaji
    The data in this table is sourced from UniChem at EBI.