Dataset

HFPO-TeA

This MassBank record with Accession MSBNK-Eawag-EQ01166552 contains the MS2 mass spectrum of HFPO-TeA with the InChIkey HPNULWLLEOKCID-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12HF23O5/c13-2(1(36)37,6(18,19)20)38-11(32,33)4(16,8(24,25)26)40-12(34,35)5(17,9(27,28)29)39-10(30,31)3(14,15)7(21,22)23/h(H,36,37)
SMILES C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)O
InChI Key HPNULWLLEOKCID-UHFFFAOYSA-N
Molecular Formula C12HF23O5
Exact Mass 661.946 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-EQ01166552
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T09:58:28.866451
MetadataModified 2025-02-09T09:58:29.088794
MetadataPublished 2024-05-15
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
36095942 eMolecules
65294-16-8 ACToR
SCHEMBL196664 SureChEMBL
DTXSID70276659 EPA CompTox Dashboard
J1.546.664B Nikkaji
182328 PubChem
The data in this table is sourced from UniChem at EBI.