ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005111
RECORD_TITLE: 5,5'-DIMETHYL-2,2'-BIPYRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 5,5'-DIMETHYL-2,2'-BIPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₂N₂
CH$EXACT_MASS: 184.10005
CH$SMILES: Cc(c2)cnc(c2)c(c1)ncc(C)c1
CH$IUPAC: InChI=1S/C12H12N2/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12/h3-8H,1-2H3
CH$LINK: INCHIKEY PTRATZCAGVBFIQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00170095

AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001i-3900000000-d9c20ecce65bd94f94a1
PK$NUM_PEAK: 97
PK$PEAK: m/z int. rel.int.
  27 1.4 14
  29 2.4 24
  30 1.7 17
  40 0.17 2
  41 11.1 111
  42 2.6 26
  43 2.9 29
  45 0.21 2
  50 2.4 24
  51 2.4 24
  52 5 50
  53 0.28 3
  55 1.7 17
  56 1.4 14
  57 3 30
  58 0.14 1
  59 1.6 16
  60 1 10
  61 1 10
  62 0.24 2
  63 5.2 52
  64 3.5 35
  65 9.9 99
  68 0.36 4
  69 1.9 19
  70 1.4 14
  71 1 10
  72 0.12 1
  73 1.2 12
  74 1.6 16
  75 1.9 19
  76 0.23 2
  77 5 50
  77.5 1 10
  78 3.1 31
  79 0.24 2
  80 1.7 17
  82 1.2 12
  83 1 10
  84 0.12 1
  84.5 1 10
  85 1.4 14
  85.5 1 10
  86 0.12 1
  87 1.2 12
  88 1.4 14
  89 2.9 29
  90 0.21 2
  91 2.8 28
  92 7.8 78
  93 2.6 26
  98 0.14 1
  99 1 10
  100 1 10
  101 1.6 16
  102 0.23 2
  105 2.3 23
  106 1.6 16
  107 1 10
  108 0.14 1
  112 1 10
  113 1.6 16
  114 2.6 26
  115 0.33 3
  116 2.3 23
  117 2.6 26
  118 1.7 17
  127 0.14 1
  128 2.4 24
  129 4.2 42
  130 2.9 29
  131 0.55 6
  132 3.3 33
  134 1.2 12
  140 1.7 17
  141 0.61 6
  142 14.4 144
  143 2.6 26
  144 1 10
  145 0.1 1
  154 1 10
  155 4.2 42
  156 5.2 52
  157 1.78 18
  158 10.7 107
  159 2.9 29
  166 1 10
  167 0.16 2
  168 3.1 31
  169 8.8 88
  171 1.7 17
  181 0.17 2
  182 4.3 43
  183 50.5 505
  184 99.99 999
  185 1.35 14
  186 1.6 16
//