ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005019
RECORD_TITLE: 2-METHYL-5-(1-OCTYNYL)PYRIDINE; 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$NAME: 2-METHYL-5-(1-OCTYNYL)PYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H19N
CH$EXACT_MASS: 201.15175
CH$SMILES: CCCCCCC#Cc(c1)cnc(C)c1
CH$IUPAC: InChI=1S/C14H19N/c1-3-4-5-6-7-8-9-14-11-10-13(2)15-12-14/h10-12H,3-7H2,1-2H3
CH$LINK: INCHIKEY SEYAUDAFZYUQRC-UHFFFAOYSA-N
AC$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: splash10-0a59-2900000000-b9737d9bfbdc234aa119
PK$NUM_PEAK: 79
PK$PEAK: m/z int. rel.int.
  38 1.7 17
  39 17.3 173
  40 2.9 29
  41 2.7 27
  42 5.2 52
  43 21.9 219
  50 5.8 58
  51 1.54 15
  52 5.2 52
  53 2.3 23
  55 7.5 75
  57 0.12 1
  62 4.1 41
  63 21.2 212
  64 4.6 46
  65 0.93 9
  66 2.4 24
  67 6.9 69
  68 1.4 14
  74 0.25 3
  75 5.3 53
  76 8.7 87
  77 42.4 424
  78 0.93 9
  79 5.2 52
  80 2.1 21
  81 1.4 14
  87 0.23 2
  88 2.3 23
  89 11 110
  90 7.5 75
  91 1.1 11
  92 3.9 39
  93 4.6 46
  94 2.7 27
  95 0.58 6
  101 3.9 39
  102 11.5 115
  103 14.8 148
  104 0.93 9
  105 3.7 37
  106 30.3 303
  107 9.8 98
  114 0.35 4
  115 14.4 144
  116 8.7 87
  117 44.3 443
  118 0.93 9
  119 11.5 115
  120 11 110
  121 3.3 33
  127 0.31 3
  128 8.7 87
  129 6.9 69
  130 69.3 693
  131 3.27 33
  132 84.6 846
  133 12.7 127
  134 1.9 19
  141 0.25 3
  142 5.7 57
  143 17.3 173
  144 52 520
  145 2.31 23
  146 7.3 73
  156 5.8 58
  157 15.4 154
  158 99.99 999
  159 30.8 308
  160 6.3 63
  170 4 40
  171 0.35 4
  172 38.5 385
  173 8.1 81
  187 8.4 84
  198 0.59 6
  200 1.6 16
  201 31.4 314
  202 5.2 52
//
