Dataset

4,4'-DIHYDROXYDIPHENYL ETHER; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008301 contains the MS mass spectrum of 4,4'-DIHYDROXYDIPHENYL ETHER with the InChIkey NZGQHKSLKRFZFL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H10O3/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8,13-14H
SMILES Oc(c2)ccc(c2)Oc(c1)ccc(O)c1
InChI Key NZGQHKSLKRFZFL-UHFFFAOYSA-N
Molecular Formula C12H10O3
Exact Mass 202.063 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-JP008301
Version
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MetadataPublished 2016-01-19
Related Molecule
  • 4-(4-hydroxyphenoxy)phenol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    15195550 PubChem: Thomson Pharma
    16069 PubChem
    SCHEMBL18198 SureChEMBL
    7L83KGH26S FDA SRS
    1965-09-9 ACToR
    70094051 NMRShiftDB
    718376 eMolecules
    ZINC000000394643 ZINC
    MCULE-9935695459 Mcule
    DTXSID8022169 EPA CompTox Dashboard
    76095 BindingDB
    J47.623D Nikkaji
    WIMCIF CCDC
    CB2728579 ChemicalBook
    CHEMBL147060 ChEMBL
    The data in this table is sourced from UniChem at EBI.