ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000539
RECORD_TITLE: 2,5-DIHYDROXYACETOPHENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: 2,5-DIHYDROXYACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H8O3
CH$EXACT_MASS: 152.04734
CH$SMILES: CC(=O)c(c1)c(O)ccc(O)1
CH$IUPAC: InChI=1S/C8H8O3/c1-5(9)7-4-6(10)2-3-8(7)11/h2-4,10-11H,1H3
CH$LINK: INCHIKEY WLDWSGZHNBANIO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9060077
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0f79-1900000000-1be284ecaa5ed9b87e30
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  43 5.94 59
  53 3.31 33
  55 1.14 11
  77 1.35 14
  78 1.92 19
  81 13.28 133
  82 1.59 16
  108 1.2 12
  109 16.53 165
  110 2.68 27
  134 4.2 42
  137 99.99 999
  138 7.68 77
  151 1.94 19
  152 85.19 852
  153 7.43 74
//
