Dataset

2-Clpfpeca-1-1

This MassBank record with Accession MSBNK-Eawag-EQ01166352 contains the MS2 mass spectrum of 2-Clpfpeca-1-1 with the InChIkey GEXXADHKKGBLLH-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10HClF18O5/c11-3(14,5(16,17)18)8(25,26)33-10(29,7(22,23)24)34-9(27,28)4(15,6(19,20)21)32-2(12,13)1(30)31/h(H,30,31)
SMILES C(=O)(C(OC(C(OC(C(F)(F)F)(OC(C(C(F)(F)F)(F)Cl)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)O
InChI Key GEXXADHKKGBLLH-UHFFFAOYSA-N
Molecular Formula C10HClF18O5
Exact Mass 577.923 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-EQ01166352
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T10:33:52.073356
MetadataModified 2025-02-09T10:33:52.270733
MetadataPublished 2024-05-15
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
163325054 PubChem
The data in this table is sourced from UniChem at EBI.