ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008433
RECORD_TITLE: O-METHOXYPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: O-METHOXYPHENOL
CH$NAME: GUAIACOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₈O₂
CH$EXACT_MASS: 124.05243
CH$SMILES: COc(c1)c(O)ccc1
CH$IUPAC: InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3
CH$LINK: INCHIKEY LHGVFZTZFXWLCP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0023113

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0pir-9700000000-f1436b3de82cff342b65
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  15 7.09 71
  26 4.99 50
  27 14.14 141
  29 5.19 52
  31 1.32 13
  37 2.87 29
  38 6.13 61
  39 14.99 150
  41 1.92 19
  49 1.45 15
  50 9.39 94
  51 13.64 136
  52 15.76 158
  53 21.26 213
  54 2.11 21
  55 4.61 46
  61 1.6 16
  62 3.87 39
  63 8.19 82
  64 2.87 29
  65 8.1 81
  66 1.54 15
  67 1.1 11
  74 1.04 10
  77 3.55 36
  79 1.7 17
  80 2.56 26
  81 80.88 809
  82 4.6 46
  95 2.66 27
  109 99.99 999
  110 6.75 68
  124 86.46 865
  125 6.83 68
//