ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004010
RECORD_TITLE: META-METHOXYPHENOL; 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$NAME: META-METHOXYPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₈O₂
CH$EXACT_MASS: 124.05243
CH$SMILES: COc(c1)cc(O)cc1
CH$IUPAC: InChI=1S/C7H8O2/c1-9-7-4-2-3-6(8)5-7/h2-5,8H,1H3
CH$LINK: INCHIKEY ASHGTJPOSUFTGB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0022012

AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-00dr-9300000000-4b13587c7cc49955ac58
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
  25 2 20
  26 7 70
  27 2.5 25
  28 0.5 5
  29 3.9 39
  30 3 30
  31 3 30
  37 0.7 7
  38 14.9 149
  39 36.2 362
  40 6.6 66
  41 1.19 12
  42 4.1 41
  43 4.1 41
  45 2.5 25
  50 1.05 11
  51 15.2 152
  52 13.5 135
  53 32 320
  55 1.2 12
  61 3 30
  62 8.4 84
  63 14.5 145
  64 0.8 8
  65 14.6 146
  66 21.3 213
  67 6.9 69
  68 0.35 4
  69 10.6 106
  73 2.3 23
  74 3.4 34
  75 0.28 3
  76 4.2 42
  77 9.8 98
  78 7.5 75
  79 0.6 6
  80 4.8 48
  81 39.5 395
  82 3.1 31
  90 0.2 2
  91 2.4 24
  92 1.8 18
  93 5.6 56
  94 5.89 59
  95 34.9 349
  96 3.7 37
  105 3 30
  106 0.16 2
  107 8 80
  108 5.2 52
  109 8.1 81
  110 0.3 3
  121 3 30
  122 2.5 25
  123 8.8 88
  124 99.99 999
  125 7.8 78
  136 6.5 65
//