ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008301
RECORD_TITLE: 4,4'-DIHYDROXYDIPHENYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA
CH$NAME: 4,4'-DIHYDROXYDIPHENYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10O3
CH$EXACT_MASS: 202.06299
CH$SMILES: Oc(c2)ccc(c2)Oc(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C12H10O3/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8,13-14H
CH$LINK: INCHIKEY NZGQHKSLKRFZFL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8022169
AC$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-0udi-7490000000-3e0345c1b056f5199f7d
PK$NUM_PEAK: 46
PK$PEAK: m/z int. rel.int.
  27 4.38 44
  39 15.74 157
  41 1.04 10
  43 2.99 30
  51 1.85 19
  53 7.37 74
  54 0.94 9
  55 4.25 43
  57 0.94 9
  63 4.41 44
  64 2.22 22
  65 12.59 126
  66 2.05 21
  69 3.64 36
  78 2.26 23
  81 9.54 95
  82 1.62 16
  91 1.17 12
  92 1.73 17
  93 2.9 29
  94 16.85 169
  95 1.37 14
  101 3.54 35
  109 16.74 167
  110 7.08 71
  115 1.26 13
  116 0.44 4
  117 2.09 21
  118 0.78 8
  119 0.87 9
  120 1.29 13
  121 1.47 15
  127 2.15 22
  128 1.43 14
  129 1.01 10
  131 3.25 33
  145 4.7 47
  146 0.51 5
  147 2.44 24
  157 1.64 16
  173 6.04 60
  174 0.66 7
  201 2.55 26
  202 99.99 999
  203 13.48 135
  204 1.34 13
//
