Dataset

4-METHYLBENZOPHENONE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP011174 contains the MS mass spectrum of 4-METHYLBENZOPHENONE with the InChIkey WXPWZZHELZEVPO-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H12O/c1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12/h2-10H,1H3
SMILES Cc(c2)ccc(c2)C(=O)c(c1)cccc1
InChI Key WXPWZZHELZEVPO-UHFFFAOYSA-N
Molecular Formula C14H12O
Exact Mass 196.089 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-JP011174
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • (4-methylphenyl)-phenylmethanone
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    FEVNAV CCDC
    J5.600F Nikkaji
    ZINC000001680440 ZINC
    DTXSID9037741 EPA CompTox Dashboard
    CB4261278 ChemicalBook
    CHEMBL371531 ChEMBL
    8652 PubChem
    B2F68X17BM FDA SRS
    SCHEMBL235 SureChEMBL
    16852606 PubChem: Thomson Pharma
    134-84-9 ACToR
    591781 eMolecules
    MCULE-5607974068 Mcule
    The data in this table is sourced from UniChem at EBI.