Dataset

2,2`-{Methylenebis[(4,1-phenylene)oxymethylene]}bis(oxirane); LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M+NH4]+

This MassBank record with Accession MSBNK-Antwerp_Univ-AN121638 contains the MS2 mass spectrum of 2,2`-{Methylenebis[(4,1-phenylene)oxymethylene]}bis(oxirane) with the InChIkey XUCHXOAWJMEFLF-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H20O4/c1-5-16(20-10-18-12-22-18)6-2-14(1)9-15-3-7-17(8-4-15)21-11-19-13-23-19/h1-8,18-19H,9-13H2
SMILES C1C(O1)COC2=CC=C(C=C2)CC3=CC=C(C=C3)OCC4CO4
InChI Key XUCHXOAWJMEFLF-UHFFFAOYSA-N
Molecular Formula C19H20O4
Exact Mass 312.136 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN121638
Version
Author
Maintainer
Language
MetadataPublished 2021-08-17
Related Molecule
  • nfdi4chem-mol82455(Unknown Molecule)
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:142451 chebi
    CHEMBL3182674 chembl
    194748 surechembl
    91511 pubchem
    V3625OQU1K fdasrs
    Molport-003-926-676 molport
    The data in this table is sourced from UniChem at EBI.