Dataset

5-methyl-1-phenyl-2(1H)-Pyridone; LC-ESI-QFT; MS2; CE: 15%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01055601 contains the MS2 mass spectrum of 5-methyl-1-phenyl-2(1H)-Pyridone with the InChIkey ISWRGOKTTBVCFA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H11NO/c1-10-7-8-12(14)13(9-10)11-5-3-2-4-6-11/h2-9H,1H3
SMILES CC1=CN(C(=O)C=C1)C2=CC=CC=C2
InChI Key ISWRGOKTTBVCFA-UHFFFAOYSA-N
Molecular Formula C12H11NO
Exact Mass 185.084 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01055601
Version
Author
Maintainer
Language
MetadataPublished 2024-06-14
Related Molecule
  • 5-methyl-1-phenylpyridin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    12012763 PubChem: Drugs of the Future
    CHEMBL1256391 ChEMBL
    DTXSID4045183 EPA CompTox Dashboard
    32016 ChEBI
    7532 Guide to Pharmacology
    J10.084F Nikkaji
    HMDB0256594 Human Metabolome Database
    KOMJOO CCDC
    PIRFENIDONE DailyMed
    ESBRIET rxnorm
    PIRFENIDONE rxnorm
    CB52511343 ChemicalBook
    HY-B0673 MedChemExpress
    PIRFENIDONE clinicaltrials
    ESBRIET clinicaltrials
    ZINC000000001958 ZINC
    4224 DrugCentral
    50005201 BindingDB
    pirfenidone Selleck
    DB04951 DrugBank
    14772813 PubChem: Thomson Pharma
    LSM-4190 LINCS
    D7NLD2JX7U FDA SRS
    53179-13-8 ACToR
    PD000334 ProbesDrugs
    593320 eMolecules
    DEUPIRFENIDONE clinicaltrials
    pirfenidone DailyMed
    CB5299210 ChemicalBook
    SCHEMBL4708 SureChEMBL
    40632 PubChem
    The data in this table is sourced from UniChem at EBI.