ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001639
RECORD_TITLE: 2,4-DIMETHYLQUINOLINE; 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$NAME: 2,4-DIMETHYLQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H11N
CH$EXACT_MASS: 157.08915
CH$SMILES: Cc(c1)nc(c2)c(ccc2)c(C)1
CH$IUPAC: InChI=1S/C11H11N/c1-8-7-9(2)12-11-6-4-3-5-10(8)11/h3-7H,1-2H3
CH$LINK: CAS 1198-37-4
CH$LINK: INCHIKEY ZTNANFDSJRRZRJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0061610
AC$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: splash10-0a4i-9600000000-8265b040c82df5bc6739
PK$NUM_PEAK: 63
PK$PEAK: m/z int. rel.int.
  37 3.54 35
  38 13.04 130
  39 48.79 488
  40 9.8 98
  41 9.1 91
  42 17.72 177
  43 1.42 14
  49 2.73 27
  50 22.06 221
  51 31.97 320
  52 11.44 114
  53 4.46 45
  54 1.16 12
  57 3.68 37
  58 1.62 16
  61 4.08 41
  62 12.6 126
  63 27.3 273
  64 12.33 123
  65 17.92 179
  66 4.89 49
  71 1.4 14
  73 1.53 15
  74 8.9 89
  75 13.62 136
  76 10.41 104
  77 20.45 205
  78 9.86 99
  79 3.94 39
  86 2.6 26
  87 4.38 44
  88 4.69 47
  89 15.31 153
  90 3.63 36
  91 3.06 31
  100 1.16 12
  101 4.37 44
  102 3.74 37
  103 2.76 28
  104 1.31 13
  113 3.11 31
  114 5.31 53
  115 29.05 291
  116 11.31 113
  117 3.54 35
  118 3.62 36
  126 1.16 12
  127 4.46 45
  128 8.14 81
  129 8.37 84
  130 7.24 72
  131 1.37 14
  140 4.5 45
  141 3.03 30
  142 11.04 110
  143 1.61 16
  154 2.65 27
  155 3.28 33
  156 29.72 297
  157 99.99 999
  158 14.01 140
  159 1.14 11
  160 2.29 23
//
