Dataset

2-ClPFPECA-0-1; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ01166051 contains the MS2 mass spectrum of 2-ClPFPECA-0-1 with the InChIkey JZLICTXOXFCCDU-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8HClF14O4/c9-3(12,5(14,15)16)7(20,21)27-8(22,23)4(13,6(17,18)19)26-2(10,11)1(24)25/h(H,24,25)
SMILES C(=O)(C(OC(C(OC(C(C(F)(F)F)(F)Cl)(F)F)(F)F)(C(F)(F)F)F)(F)F)O
InChI Key JZLICTXOXFCCDU-UHFFFAOYSA-N
Molecular Formula C8HClF14O4
Exact Mass 461.934 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-EQ01166051
Version
Author
Maintainer
Language
MetadataPublished 2024-05-15
Related Molecule
  • 2-[1-(2-chloro-1,1,2,3,3,3-hexafluoropropoxy)-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
    102331880 pubchem
    The data in this table is sourced from UniChem at EBI.