ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003874
RECORD_TITLE: IMIPRAMINE; 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$NAME: IMIPRAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₂₄N₂
CH$EXACT_MASS: 280.19395
CH$SMILES: CN(C)CCCN(c21)c(c3)c(ccc3)CCc(cccc2)1
CH$IUPAC: InChI=1S/C19H24N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-11H,7,12-15H2,1-2H3
CH$LINK: INCHIKEY BCGWQEUPMDMJNV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1043881

AC$INSTRUMENT: Unknown
AC$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$SPLASH: splash10-0019-7490000000-3fb4d40b6a219f088ec8
PK$NUM_PEAK: 192
PK$PEAK: m/z int. rel.int.
  29 3.8 38
  31 1.4 14
  33 0.3 3
  34 0.23 2
  35 20.4 204
  36 0.9 9
  37 6.4 64
  38 0.29 3
  39 0.3 3
  40 0.6 6
  41 4.9 49
  42 0.07 1
  43 8.1 81
  44 6.9 69
  45 0.9 9
  46 0.01 0
  50 0.3 3
  51 1.9 19
  52 0.9 9
  53 0.12 1
  54 0.8 8
  55 3.3 33
  56 3.7 37
  57 0.97 10
  58 78.9 789
  59 4.1 41
  60 0.3 3
  62 0.04 0
  63 1.1 11
  64 0.4 4
  65 3.1 31
  66 0.01 0
  67 0.9 9
  68 0.7 7
  69 2.9 29
  70 0.99 10
  71 6.9 69
  72 3.7 37
  73 0.7 7
  74 0.01 0
  75 0.9 9
  76 0.8 8
  77 3.6 36
  78 0.19 2
  79 1.2 12
  80 0.7 7
  81 1.5 15
  82 0.01 0
  83 2.3 23
  84 7.9 79
  85 62.9 629
  86 0.69 7
  87 0.8 8
  89 2.9 29
  90 2 20
  91 1.09 11
  92 2 20
  93 1.1 11
  94 0.6 6
  95 0.09 1
  96 0.7 7
  97 1.4 14
  98 1.2 12
  99 0.09 1
  100 0.2 2
  101 0.7 7
  102 1.3 13
  103 0.17 2
  104 2.8 28
  105 3.8 38
  106 3.9 39
  107 0.24 2
  108 0.3 3
  109 1.1 11
  110 0.6 6
  111 0.11 1
  112 1.2 12
  113 0.9 9
  115 2.2 22
  116 0.02 0
  117 4.9 49
  118 4.7 47
  119 2.9 29
  120 0.13 1
  121 0.4 4
  125 0.5 5
  126 0.9 9
  127 0.25 3
  128 2 20
  129 3.7 37
  130 14.1 141
  131 0.29 3
  132 1.3 13
  133 0.5 5
  134 0.9 9
  135 0.09 1
  136 0.1 1
  139 1.1 11
  140 4.3 43
  141 0.09 1
  142 1.3 13
  143 1.3 13
  144 1.4 14
  145 0.05 1
  148 0.1 1
  149 1.6 16
  150 0.4 4
  151 0.13 1
  152 1.9 19
  153 0.9 9
  154 1.1 11
  155 0.11 1
  156 0.8 8
  157 0.1 1
  158 0.1 1
  159 0.14 1
  160 0.1 1
  161 0.1 1
  162 0.5 5
  163 0.07 1
  164 0.9 9
  165 4.9 49
  166 2.6 26
  167 0.39 4
  168 1.1 11
  169 0.9 9
  170 0.1 1
  175 0.03 0
  176 0.9 9
  177 0.9 9
  178 5.4 54
  179 0.59 6
  180 3.9 39
  181 1.1 11
  182 0.4 4
  183 0.01 0
  185 0.4 4
  187 0.1 1
  188 0.1 1
  189 0.09 1
  190 1.5 15
  191 3.9 39
  192 6.9 69
  193 2.39 24
  194 18.4 184
  195 29.4 294
  196 4.9 49
  197 0.11 1
  198 0.5 5
  199 0.9 9
  200 0.1 1
  202 0.06 1
  203 0.9 9
  204 3.9 39
  205 2.3 23
  206 0.91 9
  207 3.4 34
  208 20.3 203
  209 5.9 59
  210 0.15 2
  211 0.4 4
  212 0.9 9
  213 0.7 7
  216 0.03 0
  217 1.1 11
  218 2.9 29
  219 2.3 23
  220 1.14 11
  221 2.9 29
  222 4.9 49
  223 1.1 11
  224 0.01 0
  232 1.1 11
  233 5.4 54
  234 64.9 649
  235 99.99 999
  236 16.9 169
  237 1.9 19
  238 0.4 4
  247 0.01 0
  248 0.7 7
  249 1.4 14
  250 0.3 3
  251 0.01 0
  264 0.1 1
  265 0.6 6
  266 0.1 1
  279 0.01 0
  280 48.9 489
  281 10.4 104
  282 1.3 13
  283 0.3 3
//