Dataset

Triethylene Glycol Monododecyl Ether; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01034501 contains the MS2 mass spectrum of Triethylene Glycol Monododecyl Ether with the InChIkey FKMHSNTVILORFA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C18H38O4/c1-2-3-4-5-6-7-8-9-10-11-13-20-15-17-22-18-16-21-14-12-19/h19H,2-18H2,1H3
SMILES CCCCCCCCCCCCOCCOCCOCCO
InChI Key FKMHSNTVILORFA-UHFFFAOYSA-N
Molecular Formula C18H38O4
Exact Mass 318.277 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-EQ01034501
Version
Author
Maintainer
Language
MetadataPublished 2023-08-10
Related Molecule
  • 2-[2-(2-dodecoxyethoxy)ethoxy]ethanol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1651993 chembl
    61079 surechembl
    76458 pubchem
    F32E4CB0UJ fdasrs
    Molport-003-939-661 molport
    The data in this table is sourced from UniChem at EBI.