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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006301

2,6-DIMETHYLANILINE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006301
RECORD_TITLE: 2,6-DIMETHYLANILINE; 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$NAME: 2,6-DIMETHYLANILINE
CH$NAME: 2,6-XYLIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H11N
CH$EXACT_MASS: 121.08915
CH$SMILES: Cc(c1)c(N)c(C)cc1
CH$IUPAC: InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3
CH$LINK: CAS 87-62-7
CH$LINK: INCHIKEY UFFBMTHBGFGIHF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8026307

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$SPLASH: splash10-0kmi-9400000000-1d6fefd12c8955bae28e
PK$NUM_PEAK: 63
PK$PEAK: m/z int. rel.int.
  14 3.54 35
  15 26.73 267
  29 6.91 69
  30 11.45 115
  32 1.53 15
  37 7.54 75
  38 21.79 218
  39 77.53 775
  40 11.41 114
  41 22.46 225
  42 21.07 211
  43 2.76 28
  47 2.19 22
  49 1.95 20
  50 23.14 231
  51 40.78 408
  52 39.93 399
  53 23.98 240
  54 19.6 196
  55 2.84 28
  56 0.9 9
  59 3.6 36
  60 3.26 33
  61 4.7 47
  62 12.35 124
  63 25.34 253
  64 7.35 74
  65 25.3 253
  66 12.31 123
  67 5.77 58
  68 2.27 23
  74 4.13 41
  75 4.3 43
  76 5.36 54
  77 37.31 373
  78 26.35 264
  79 12.57 126
  80 12.09 121
  81 2.15 22
  85 0.65 7
  86 1.32 13
  87 1.19 12
  88 0.6 6
  89 4.99 50
  90 2.22 22
  91 24.41 244
  92 7.88 79
  93 20.79 208
  94 10.86 109
  95 1.36 14
  102 2.88 29
  103 11.81 118
  104 9.21 92
  105 4.4 44
  106 99.99 999
  107 8.47 85
  116 0.51 5
  117 1.59 16
  118 4.3 43
  119 2.52 25
  120 59.39 594
  121 99.61 996
  122 9.28 93
//

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