ACCESSION: MSBNK-EPA-ENTACT_AGILENT001303
RECORD_TITLE: 3-Hydroxy-2-pyridone; ESI-QTOF; MS2; CE: 40; [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 40

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$SPLASH: splash10-0udr-9000000000-49352e83eb48b138cbc7
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  38.015101 1.87802 18
  39.022927 92.294972 922
  40.018175 19.39139 193
  40.030752 2.02549 20
  42.033826 3.350695 33
  43.017841 3.639172 36
  51.022927 1.376262 13
  52.018175 11.096072 110
  53.99744 99.999999 999
  64.018175 3.096672 30
  66.010016 1.199149 11
  66.033826 17.292011 172
  67.017841 6.336603 63
  68.01309 1.47239 14
  75.01035 2.788159 27
  76.018175 3.968679 39
  94.02874 4.268603 42
//