ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006342
RECORD_TITLE: 2,4-DIHYDROXYACETOPHENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: EGUCHI S, FAC. OF SCIENCE, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2,4-DIHYDROXYACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈O₃
CH$EXACT_MASS: 152.04734
CH$SMILES: CC(=O)c(c1)c(O)cc(O)c1
CH$IUPAC: InChI=1S/C8H8O3/c1-5(9)7-3-2-6(10)4-8(7)11/h2-4,10-11H,1H3
CH$LINK: INCHIKEY SULYEHHGGXARJS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4058998

AC$INSTRUMENT: HITACHI RMU-7L
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-000i-3900000000-2c2de3cf148f6a68d182
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  41 3 30
  42 2.9 29
  43 8.2 82
  51 0.3 3
  52 2.4 24
  53 7.4 74
  54 2.5 25
  55 0.4 4
  62 2.1 21
  63 3.5 35
  64 1 10
  65 0.15 2
  69 8.5 85
  77 2.7 27
  78 2 20
  79 0.22 2
  80 2.2 22
  81 11.8 118
  82 2.5 25
  95 0.18 2
  105 2 20
  108 2.5 25
  109 4.5 45
  110 0.25 3
  123 3 30
  137 99.99 999
  138 8.5 85
  139 0.25 3
  152 46 460
  153 5 50
  154 1 10
//