ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009542
RECORD_TITLE: PARA-METHOXYTOLUENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: PARA-METHOXYTOLUENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O
CH$EXACT_MASS: 122.07316
CH$SMILES: COc(c1)ccc(C)c1
CH$IUPAC: InChI=1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3
CH$LINK: CAS 104-93-8
CH$LINK: INCHIKEY CHLICZRVGGXEOD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9026710

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-00fr-9800000000-7bf81d1ff4cffad22e15
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  26 1.19 12
  28 2.29 23
  29 2.41 24
  30 1.05 11
  38 1.87 19
  39 8.11 81
  41 1.1 11
  50 5.66 57
  51 13.77 138
  52 6.15 62
  53 7.25 73
  61 1.24 12
  62 3.05 31
  63 6.9 69
  64 1.99 20
  65 7.54 75
  74 1.38 14
  75 1.13 11
  76 1.05 11
  77 40.2 402
  78 14.48 145
  79 29.47 295
  80 2.01 20
  89 3.55 36
  90 1.83 18
  91 20.98 210
  92 8.54 85
  93 1.58 16
  107 30.52 305
  108 3.17 32
  121 40.36 404
  122 99.99 999
  123 9.05 91
//