ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010492
RECORD_TITLE: 2,3-DIMETHYLPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: 2,3-DIMETHYLPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O
CH$EXACT_MASS: 122.07316
CH$SMILES: Cc(c1)c(C)c(O)cc1
CH$IUPAC: InChI=1S/C8H10O/c1-6-4-3-5-8(9)7(6)2/h3-5,9H,1-2H3
CH$LINK: INCHIKEY QWBBPBRQALCEIZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6025143

AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-05i0-8900000000-51d723e665d09753d245
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
  15 2.24 22
  26 2.34 23
  27 11.29 113
  29 2.81 28
  37 1.41 14
  38 4.51 45
  39 21.61 216
  40 3.27 33
  41 6.16 62
  43 3.61 36
  50 6.99 70
  51 15.24 152
  52 6.05 61
  53 10.53 105
  54 1.1 11
  55 3.78 38
  60 2.41 24
  61 2.49 25
  62 3.28 33
  63 8.28 83
  64 2.04 20
  65 9.91 99
  66 3.37 34
  67 2.48 25
  74 2.05 21
  75 1.79 18
  76 1.29 13
  77 32.95 330
  78 12.28 123
  79 21.14 211
  80 2.09 21
  81 1.28 13
  89 1.75 18
  91 20.42 204
  92 2.96 30
  93 5 50
  94 5.21 52
  95 1.16 12
  102 1.42 14
  103 7.63 76
  104 5.55 56
  105 3.57 36
  107 99.99 999
  108 8 80
  120 1.23 12
  121 30.98 310
  122 98.84 988
  123 1.54 15
//