Dataset

3-ETHOXY-4-HYDROXYBENZALDEHYDE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008446 contains the MS mass spectrum of 3-ETHOXY-4-HYDROXYBENZALDEHYDE with the InChIkey CBOQJANXLMLOSS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H10O3/c1-2-12-9-5-7(6-10)3-4-8(9)11/h3-6,11H,2H2,1H3
SMILES CCOc(c1)c(O)ccc(C=O)1
InChI Key CBOQJANXLMLOSS-UHFFFAOYSA-N
Molecular Formula C9H10O3
Exact Mass 166.063 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP008446
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 3-ethoxy-4-hydroxybenzaldehyde
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:48408 chebi
    N36 rcsb_pdb
    CHEMBL508676 chembl
    29351334 surechembl
    30247 surechembl
    8467 pubchem
    PD000824 probes_and_drugs
    ROFZOC CCDC
    195533 brenda
    221639 brenda
    N36 pdbe
    YC9ST449YJ fdasrs
    HMDB0029665 hmdb
    Molport-000-492-568 molport
    The data in this table is sourced from UniChem at EBI.