ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003109
RECORD_TITLE: DIETHYLPROPION, DONYLEN,DOBESIN; 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$NAME: DIETHYLPROPION, DONYLEN,DOBESIN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₉NO
CH$EXACT_MASS: 205.14666
CH$SMILES: CCN(CC)C(C)C(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C13H19NO/c1-4-14(5-2)11(3)13(15)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3
CH$LINK: INCHIKEY XXEPPPIWZFICOJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6022929

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0udi-9600000000-6ee5a640521355e9e385
PK$NUM_PEAK: 139
PK$PEAK: m/z int. rel.int.
  24 0.1 1
  25 0.9 9
  26 4.3 43
  27 1.21 12
  28 35.3 353
  29 11.9 119
  30 4.3 43
  31 0.01 0
  32 1.7 17
  35 0.3 3
  36 1.7 17
  37 0.07 1
  38 1.1 11
  39 4.1 41
  40 1.7 17
  41 0.59 6
  42 14.9 149
  43 3.4 34
  44 28.3 283
  45 0.11 1
  49 0.3 3
  50 4.4 44
  51 11.7 117
  52 0.26 3
  53 0.9 9
  54 1.8 18
  55 2.7 27
  56 1.09 11
  57 2.3 23
  58 3.3 33
  59 0.1 1
  61 0.01 0
  62 0.7 7
  63 1.7 17
  64 0.8 8
  65 0.15 2
  66 0.3 3
  67 0.5 5
  68 1.6 16
  69 0.11 1
  70 6.7 67
  71 1.7 17
  72 20 200
  73 0.16 2
  74 1.3 13
  75 1.4 14
  76 2.1 21
  77 1.79 18
  78 5.8 58
  79 2.1 21
  80 0.1 1
  81 0.04 0
  82 0.1 1
  83 0.8 8
  84 1.3 13
  85 0.08 1
  86 1.3 13
  87 0.2 2
  88 0.1 1
  89 0.18 2
  90 0.9 9
  91 4 40
  92 0.9 9
  93 0.03 0
  95 0.3 3
  96 0.1 1
  97 0.3 3
  98 0.26 3
  99 1 10
  100 99.99 999
  101 8.3 83
  102 0.17 2
  103 1.9 19
  104 2.6 26
  105 14.9 149
  106 0.22 2
  107 0.3 3
  114 0.1 1
  115 4.4 44
  116 0.21 2
  117 2.1 21
  118 1.3 13
  119 0.3 3
  120 0.07 1
  121 0.1 1
  126 0.3 3
  127 0.7 7
  128 0.13 1
  129 1.4 14
  130 1.2 12
  131 1.4 14
  132 0.17 2
  133 1.1 11
  134 1.7 17
  135 0.3 3
  139 0.01 0
  141 0.2 2
  142 0.2 2
  143 0.9 9
  144 0.13 1
  145 0.4 4
  146 0.7 7
  147 0.5 5
  154 0.05 1
  155 0.1 1
  156 0.9 9
  157 0.5 5
  158 0.05 1
  159 0.8 8
  160 0.8 8
  161 0.1 1
  162 0.19 2
  163 0.3 3
  167 0.3 3
  168 0.4 4
  169 0.01 0
  170 0.6 6
  171 0.1 1
  172 0.8 8
  173 0.02 0
  174 0.3 3
  175 0.2 2
  176 0.5 5
  177 0.01 0
  181 0.1 1
  183 0.2 2
  184 0.4 4
  185 0.11 1
  186 1.1 11
  187 0.3 3
  188 0.8 8
  189 0.09 1
  190 0.3 3
  201 0.3 3
  202 0.8 8
  203 0.03 0
  204 0.4 4
  205 0.5 5
  206 0.1 1
//