ACCESSION: MSBNK-EPA-ENTACT_AGILENT001301
RECORD_TITLE: 3-Hydroxy-2-pyridone; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3-Hydroxy-2-pyridone
CH$NAME: DTXSID0051782
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₅NO₂
CH$EXACT_MASS: 111.0320284115
CH$SMILES: O=C1CCC=NC1=O
CH$IUPAC: InChI=1S/C5H5NO2/c7-4-2-1-3-6-5(4)8/h3H,1-2H2
CH$LINK: CAS 16867-04-2
CH$LINK: INCHIKEY UVHNFZKPTQUPLV-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:28115

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

MS$FOCUSED_ION: PRECURSOR_M/Z 112.0393048632
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00kf-9100000000-cae382c838e35d7b953c
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  39.022927 20.437557 204
  41.038577 1.234101 12
  42.033826 1.360596 13
  52.018175 1.05446 10
  53.99744 5.230443 52
  66.033826 42.954396 429
  67.017841 15.438798 154
  68.01309 1.196143 11
  84.04439 1.172818 11
  94.02874 99.999997 999
  112.039305 38.725309 386
//