ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005723
RECORD_TITLE: 3'-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$NAME: 3'-HYDROXYACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈O₂
CH$EXACT_MASS: 136.05243
CH$SMILES: CC(=O)c(c1)cc(O)cc1
CH$IUPAC: InChI=1S/C8H8O2/c1-6(9)7-3-2-4-8(10)5-7/h2-5,10H,1H3
CH$LINK: CAS 121-71-1
CH$LINK: INCHIKEY LUJMEECXHPYQOF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5059533

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$SPLASH: splash10-00dr-5900000000-a9b3335e6ee8587c87ef
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  15 1.62 16
  26 0.46 5
  27 1.01 10
  37 0.73 7
  38 2.34 23
  39 9.95 100
  40 0.62 6
  42 1.09 11
  43 10.75 108
  44 0.39 4
  50 1.65 17
  51 1.77 18
  52 0.59 6
  53 2.03 20
  55 0.35 4
  60 0.61 6
  61 0.86 9
  62 1.89 19
  63 4.71 47
  64 2.58 26
  65 18.01 180
  66 2.17 22
  74 0.77 8
  75 0.67 7
  76 0.44 4
  77 1.87 19
  78 0.5 5
  79 0.54 5
  92 1.63 16
  93 37.67 377
  94 4.18 42
  121 99.99 999
  122 7.99 80
  123 0.68 7
  135 0.2 2
  136 71.64 716
  137 7.01 70
  138 0.59 6
//