ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006303
RECORD_TITLE: 2,4,6-TRIMETHYLANILINE; 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$NAME: 2,4,6-TRIMETHYLANILINE
CH$NAME: MESIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₃N
CH$EXACT_MASS: 135.10480
CH$SMILES: Cc(c1)cc(C)c(N)c(C)1
CH$IUPAC: InChI=1S/C9H13N/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,10H2,1-3H3
CH$LINK: CAS 88-05-1
CH$LINK: INCHIKEY KWVPRPSXBZNOHS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5043847

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$SPLASH: splash10-0080-9700000000-d968eac9ad8e411b2f47
PK$NUM_PEAK: 73
PK$PEAK: m/z int. rel.int.
  13 1.06 11
  14 2.39 24
  15 18.39 184
  17 2.58 26
  18 1.97 20
  26 3.93 39
  27 30.12 301
  28 19.89 199
  29 16.8 168
  30 5.81 58
  31 16.4 164
  32 14.09 141
  37 1.8 18
  38 7.26 73
  39 38.01 380
  40 6.63 66
  41 15.01 150
  42 11.14 111
  43 1.5 15
  50 7.2 72
  51 15.93 159
  52 13.69 137
  53 10.92 109
  54 9.21 92
  55 1.93 19
  58 1.95 20
  59 1.93 19
  60 0.99 10
  61 1.03 10
  62 3.98 40
  63 10.73 107
  64 3.43 34
  65 15.22 152
  66 6.75 68
  67 3.93 39
  68 3.12 31
  74 2.13 21
  75 2.15 22
  76 2.17 22
  77 16.23 162
  78 7.32 73
  79 8.95 90
  80 6.07 61
  81 1.18 12
  86 0.57 6
  87 0.73 7
  89 2.9 29
  90 1.73 17
  91 23.06 231
  92 4.96 50
  93 9.09 91
  94 5.23 52
  95 1.18 12
  102 1.64 16
  103 4.44 44
  104 3.56 36
  105 3.16 32
  106 8.52 85
  107 5.18 52
  108 3.59 36
  115 5.26 53
  116 2.04 20
  117 6.51 65
  118 6.62 66
  119 5.68 57
  120 99.16 992
  121 9.58 96
  130 0.92 9
  132 2.77 28
  133 2.02 20
  134 57.12 571
  135 99.99 999
  136 10.64 106
//