ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000750
RECORD_TITLE: 2-HYDROXY-5,7-DIMETHOXY-1,4-NAPHTHOQUINONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 2-HYDROXY-5,7-DIMETHOXY-1,4-NAPHTHOQUINONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10O5
CH$EXACT_MASS: 234.05282
CH$SMILES: COc(c1)cc(c(=O)2)c(c(=O)cc(O)2)c(OC)1
CH$IUPAC: InChI=1S/C12H10O5/c1-16-6-3-7-11(10(4-6)17-2)8(13)5-9(14)12(7)15/h3-5,14H,1-2H3
CH$LINK: INCHIKEY ADTSNWYKAAWAQG-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMS-4
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: splash10-001i-8940000000-95ede05813ff16a24c61
PK$NUM_PEAK: 144
PK$PEAK: m/z int. rel.int.
  39 15 150
  40 5 50
  41 12 120
  42 0.8 8
  43 23 230
  44 5 50
  45 6 60
  46 0.2 2
  50 10 100
  51 18 180
  52 7 70
  53 0.9 9
  54 5 50
  55 20 200
  56 4 40
  57 0.9 9
  58 2 20
  59 10 100
  60 4 40
  61 0.5 5
  62 9 90
  63 15 150
  64 6 60
  65 1.3 13
  66 4 40
  67 2 20
  68 4 40
  69 0.3 3
  70 14 140
  71 5 50
  72 6 60
  73 0.6 6
  74 5 50
  75 7 70
  76 8 80
  77 2.3 23
  78 8 80
  79 6 60
  80 8 80
  81 0.3 3
  82 3 30
  83 6 60
  84 3 30
  85 0.6 6
  86 3 30
  87 4 40
  88 4 40
  89 1 10
  90 7 70
  91 12 120
  92 10 100
  93 0.6 6
  94 4 40
  95 4 40
  96 3 30
  97 0.4 4
  98 3 30
  99 4 40
  100 5 50
  101 0.5 5
  102 6 60
  103 12 120
  104 5 50
  105 1 10
  106 6 60
  107 8 80
  108 3 30
  109 0.3 3
  110 2 20
  111 2 20
  112 2 20
  113 0.1 1
  114 1 10
  115 5 50
  116 3 30
  117 0.6 6
  118 6 60
  119 8 80
  120 6 60
  121 0.6 6
  122 3 30
  123 2 20
  124 2 20
  125 0.2 2
  126 2 20
  127 3 30
  128 3 30
  129 0.3 3
  130 4 40
  131 10 100
  132 9 90
  133 0.8 8
  134 9 90
  135 14 140
  136 5 50
  137 0.4 4
  138 4 40
  139 2 20
  140 2 20
  141 0.2 2
  142 2 20
  143 3 30
  144 4 40
  145 0.5 5
  146 7 70
  147 9 90
  148 10 100
  149 0.9 9
  150 5 50
  151 4 40
  152 2 20
  153 0.1 1
  158 3 30
  159 6 60
  160 10 100
  161 9.4 94
  162 16 160
  163 9 90
  164 11 110
  173 0.5 5
  174 13 130
  175 27 270
  176 13 130
  177 0.6 6
  178 3 30
  187 4 40
  188 6 60
  189 0.5 5
  190 6 60
  191 6 60
  192 3 30
  202 2.1 21
  203 14 140
  204 5 50
  205 16 160
  206 0.7 7
  216 3 30
  217 3 30
  218 3 30
  219 0.2 2
  233 11 110
  234 99.99 999
  235 16 160
  236 3 30
//
