Dataset

META-METHYLPHENETOLE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004024 contains the MS mass spectrum of META-METHYLPHENETOLE with the InChIkey UALKQROXOHJHFG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H12O/c1-3-10-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3
SMILES CCOc(c1)cc(C)cc1
InChI Key UALKQROXOHJHFG-UHFFFAOYSA-N
Molecular Formula C9H12O
Exact Mass 136.089 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-JP004024
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 1-ethoxy-3-methylbenzene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J30.192B Nikkaji
    69305 PubChem
    JZ7GFC4MN9 FDA SRS
    DTXSID4060733 EPA CompTox Dashboard
    MCULE-3762844024 Mcule
    ZINC000001693362 ZINC
    16250637 PubChem: Thomson Pharma
    SCHEMBL129831 SureChEMBL
    31656911 eMolecules
    621-32-9 ACToR
    The data in this table is sourced from UniChem at EBI.