ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004068
RECORD_TITLE: 2,5-DIMETHYLPHENOL; 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$NAME: 2,5-DIMETHYLPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O
CH$EXACT_MASS: 122.07316
CH$SMILES: Cc(c1)cc(O)c(C)c1
CH$IUPAC: InChI=1S/C8H10O/c1-6-3-4-7(2)8(9)5-6/h3-5,9H,1-2H3
CH$LINK: INCHIKEY NKTOLZVEWDHZMU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6025145

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$SPLASH: splash10-00di-8900000000-1425cd74879c3086c0ba
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  39 27.8 278
  40 2.9 29
  41 6.5 65
  42 0.11 1
  43 3.9 39
  45 1.1 11
  49 0.9 9
  50 1.1 11
  51 19.3 193
  52 5.6 56
  53 11.5 115
  54 1.22 12
  55 2 20
  59 1 10
  60 2.2 22
  61 0.24 2
  62 2.1 21
  63 7.5 75
  65 8.4 84
  66 0.25 3
  67 1.8 18
  74 2 20
  76 14 140
  77 3 30
  78 9.4 94
  79 15.8 158
  80 1 10
  81 0.76 8
  89 1 10
  91 18.5 185
  92 2.2 22
  93 0.35 4
  94 2.7 27
  95 1 10
  102 1.1 11
  103 0.54 5
  104 5.9 59
  105 3 30
  106 6.1 61
  107 8.59 86
  108 5.5 55
  121 42.9 429
  122 99.99 999
  123 7.1 71
//