ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001628
RECORD_TITLE: 2,3-DIMETHYLANILINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA
CH$NAME: 2,3-DIMETHYLANILINE
CH$NAME: 2,3-XYLIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H11N
CH$EXACT_MASS: 121.08915
CH$SMILES: Cc(c1)c(C)c(N)cc1
CH$IUPAC: InChI=1S/C8H11N/c1-6-4-3-5-8(9)7(6)2/h3-5H,9H2,1-2H3
CH$LINK: INCHIKEY VVAKEQGKZNKUSU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3026304
AC$INSTRUMENT: VARIAN MAT-44
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: splash10-05i0-9600000000-17dbf3d71ca63ff691d9
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
  30 7.75 78
  37 2.19 22
  38 7.71 77
  39 32.13 321
  40 3.31 33
  41 13.94 139
  42 18.1 181
  43 2.59 26
  46 4.11 41
  47 1.47 15
  49 1.43 14
  50 10.63 106
  51 18.5 185
  52 17.62 176
  53 17.58 176
  54 7.47 75
  58 10.63 106
  59 12.58 126
  60 9.35 94
  61 2.03 20
  62 4.15 42
  63 4.99 50
  64 5.55 56
  65 9.87 99
  66 4.23 42
  67 2.27 23
  74 1.55 16
  75 1.67 17
  76 2.23 22
  77 38.32 383
  78 19.38 194
  79 21.46 215
  80 12.39 124
  81 1.55 16
  89 2.99 30
  90 1.87 19
  91 21.86 219
  92 5.59 56
  93 10.67 107
  94 3.31 33
  102 2.07 21
  103 12.31 123
  104 6.47 65
  105 3.75 38
  106 99.99 999
  107 8.31 83
  117 2.07 21
  118 6.11 61
  119 5.23 52
  120 44.6 446
  121 81.69 817
  122 7.19 72
//
