Dataset

Etoxazole; LC-ESI-QFT; MS2; CE: 30%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ00409202 contains the MS2 mass spectrum of Etoxazole with the InChIkey IXSZQYVWNJNRAL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H23F2NO2/c1-5-25-18-11-13(21(2,3)4)9-10-14(18)17-12-26-20(24-17)19-15(22)7-6-8-16(19)23/h6-11,17H,5,12H2,1-4H3
SMILES CCOC1=C(C=CC(=C1)C(C)(C)C)C2COC(=N2)C3=C(C=CC=C3F)F
InChI Key IXSZQYVWNJNRAL-UHFFFAOYSA-N
Molecular Formula C21H23F2NO2
Exact Mass 359.170 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-EQ00409202
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MetadataPublished 2024-06-14
Related Molecule
  • 4-(4-tert-butyl-2-ethoxyphenyl)-2-(2,6-difluorophenyl)-4,5-dihydro-1,3-oxazole
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:39329 chebi
    CHEMBL1881674 chembl
    27300 surechembl
    29376426 surechembl
    153974 pubchem
    LBE5H21G6L fdasrs
    PD064945 probes_and_drugs
    HMDB0252119 hmdb
    Molport-019-992-324 molport
    The data in this table is sourced from UniChem at EBI.