ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007364
RECORD_TITLE: 1,3-DIMETHOXYBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 1,3-DIMETHOXYBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O₂
CH$EXACT_MASS: 138.06808
CH$SMILES: COc(c1)cc(OC)cc1
CH$IUPAC: InChI=1S/C8H10O2/c1-9-7-4-3-5-8(6-7)10-2/h3-6H,1-2H3
CH$LINK: CAS 151-10-0
CH$LINK: INCHIKEY DPZNOMCNRMUKPS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2047060

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-000i-9700000000-4a1b86bad29afd7b67a9
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  15 3.48 35
  26 1.54 15
  27 1.48 15
  28 2.26 23
  37 1.25 13
  38 4.88 49
  39 8.49 85
  41 11.29 113
  50 4.58 46
  51 6.22 62
  52 10.23 102
  53 1.66 17
  62 2.76 28
  63 10.02 100
  64 9.72 97
  65 16.5 165
  66 1.51 15
  67 2.38 24
  69 2.31 23
  74 1.33 13
  76 1.18 12
  77 8.85 89
  78 21.62 216
  79 6.05 61
  80 6.16 62
  92 6.91 69
  93 6.57 66
  94 3.12 31
  95 20.37 204
  96 1.23 12
  105 1.11 11
  107 5.05 51
  108 15.05 151
  109 26.48 265
  110 2.01 20
  123 1.14 11
  137 2.47 25
  138 99.99 999
  139 9.15 92
//