Dataset

ANETHOLE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP009172 contains the MS mass spectrum of ANETHOLE with the InChIkey RUVINXPYWBROJD-ONEGZZNKSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+
SMILES CC=Cc(c1)ccc(OC)c1
InChI Key RUVINXPYWBROJD-ONEGZZNKSA-N
Molecular Formula C10H12O
Exact Mass 148.089 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-JP009172
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 1-methoxy-4-[(E)-prop-1-enyl]benzene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB15916 drugbank
    CHEBI:35616 chebi
    CHEMBL452630 chembl
    48599 surechembl
    637563 pubchem
    Q3JEK5DO4K fdasrs
    PD000888 probes_and_drugs
    TUTZAM CCDC
    154344 brenda
    19099 brenda
    Molport-002-507-189 molport
    The data in this table is sourced from UniChem at EBI.