ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005724
RECORD_TITLE: 4'-HYDROXYACETOPHENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 4'-HYDROXYACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈O₂
CH$EXACT_MASS: 136.05243
CH$SMILES: CC(=O)c(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3
CH$LINK: CAS 99-93-4
CH$LINK: INCHIKEY TXFPEBPIARQUIG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0029133

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 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-00di-4900000000-f41eb3843ff66e46c111
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  15 1.52 15
  18 0.17 2
  26 0.47 5
  27 0.93 9
  28 0.72 7
  29 0.54 5
  37 0.67 7
  38 1.9 19
  39 8.98 90
  42 0.97 10
  43 5.67 57
  50 1.64 16
  51 1.74 17
  52 0.56 6
  53 1.91 19
  54 0.31 3
  55 0.54 5
  60 0.4 4
  61 0.81 8
  62 1.8 18
  63 3.92 39
  64 1.87 19
  65 14.46 145
  66 1.44 14
  67 0.27 3
  74 0.82 8
  75 0.58 6
  76 0.32 3
  77 1.82 18
  78 0.36 4
  79 0.64 6
  92 1.72 17
  93 20.82 208
  94 2.04 20
  107 1.13 11
  120 0.55 6
  121 99.99 999
  122 8.13 81
  123 0.68 7
  136 45.43 454
  137 4.5 45
  138 0.37 4
//