ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004343
RECORD_TITLE: 3-(3-AMINOPROPYL)-5-METHOXY-2-METHYLINDOLE; 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$NAME: 3-(3-AMINOPROPYL)-5-METHOXY-2-METHYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H18N2O
CH$EXACT_MASS: 218.14191
CH$SMILES: CC1=C(C2=C(N1)C=CC(=C2)OC)CCCN
CH$IUPAC: InChI=1S/C13H18N2O/c1-9-11(4-3-7-14)12-8-10(16-2)5-6-13(12)15-9/h5-6,8,15H,3-4,7,14H2,1-2H3
CH$LINK: INCHIKEY XBGHNWZQUGBIMR-UHFFFAOYSA-N
AC$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: splash10-00di-1920000000-d1936ac85bb96b055a24
PK$NUM_PEAK: 91
PK$PEAK: m/z int. rel.int.
  27 4.6 46
  29 3 30
  30 8.5 85
  39 0.34 3
  40 1.2 12
  41 4.7 47
  42 3.8 38
  43 0.56 6
  45 5.6 56
  51 1.6 16
  52 1.3 13
  53 0.13 1
  54 1 10
  55 3.1 31
  56 2.6 26
  57 0.31 3
  63 1.6 16
  64 1 10
  65 1.7 17
  67 0.16 2
  69 1.4 14
  70 1 10
  71 1.3 13
  76 0.12 1
  77 4.8 48
  78 2.1 21
  79 1.5 15
  80 0.1 1
  81 1.2 12
  89 2.2 22
  90 1.2 12
  91 0.37 4
  102 1.7 17
  103 4.7 47
  104 1.8 18
  105 0.12 1
  115 4.8 48
  116 2.8 28
  117 5.7 57
  118 0.4 4
  127 1.7 17
  128 3.2 32
  129 2.8 28
  130 1.19 12
  131 18.4 184
  132 5.6 56
  133 1.4 14
  141 0.13 1
  142 2.8 28
  143 6.3 63
  144 13.5 135
  145 0.6 6
  146 7.2 72
  147 3 30
  154 3.2 32
  155 0.29 3
  156 3.3 33
  157 4.3 43
  158 16.4 164
  159 2.59 26
  160 22.4 224
  161 11.9 119
  162 10.8 108
  163 0.16 2
  168 1.5 15
  169 2.1 21
  170 22.4 224
  171 0.47 5
  172 5.7 57
  173 15.6 156
  174 99.99 999
  175 3.48 35
  176 4 40
  182 1 10
  183 1.3 13
  184 0.15 2
  185 2 20
  186 15.8 158
  187 7.6 76
  188 1.68 17
  189 4.1 41
  197 1.3 13
  198 1 10
  200 0.62 6
  201 31.1 311
  202 4 40
  203 1 10
  214 0.14 1
  216 1.8 18
  218 44.9 449
  219 7 70
//
