ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004338
RECORD_TITLE: 3A,7,8A-TRIMETHYL-2,3,3A,8A-TETRAHYDROPYRROLO(2,3-B)INDOLE; 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$NAME: 3A,7,8A-TRIMETHYL-2,3,3A,8A-TETRAHYDROPYRROLO(2,3-B)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₈N₂
CH$EXACT_MASS: 202.14700
CH$SMILES: Cc(c3)c(N1)c(cc3)C(C)(C2)C(C)(NC2)1
CH$IUPAC: InChI=1S/C13H18N2/c1-9-5-4-6-10-11(9)15-13(3)12(10,2)7-8-14-13/h4-6,14-15H,7-8H2,1-3H3
CH$LINK: INCHIKEY ZKBWLNANRNSTME-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$SPLASH: splash10-0a4i-2900000000-152faebd88c2a2d3f18a
PK$NUM_PEAK: 78
PK$PEAK: m/z int. rel.int.
  27 4.3 43
  29 2.1 21
  30 13.5 135
  39 0.64 6
  40 1.5 15
  41 4.5 45
  42 5.6 56
  43 0.44 4
  50 1.5 15
  51 4.9 49
  52 2.1 21
  53 0.33 3
  54 1.5 15
  55 1.9 19
  56 1.9 19
  63 0.41 4
  64 1.7 17
  65 6 60
  75 1.9 19
  76 0.14 1
  77 7.9 79
  78 2.3 23
  79 3.1 31
  80 0.19 2
  89 5.1 51
  90 1.9 19
  91 13.9 139
  92 0.23 2
  96 3.1 31
  101 1.7 17
  102 2.9 29
  103 0.36 4
  104 1.8 18
  105 2.3 23
  114 1.7 17
  115 2.32 23
  116 8.9 89
  117 6.6 66
  118 2.5 25
  119 0.16 2
  120 1.3 13
  127 3.8 38
  128 7.8 78
  129 0.66 7
  130 7.2 72
  131 4.4 44
  132 3.3 33
  140 0.13 1
  141 2.7 27
  142 5.4 54
  143 8.8 88
  144 2.58 26
  145 3.3 33
  146 3.3 33
  154 2.7 27
  155 0.19 2
  156 9.1 91
  157 15.6 156
  158 99.99 999
  159 9.2 92
  160 19.5 195
  161 5 50
  168 1 10
  169 0.12 1
  170 5.4 54
  171 8.1 81
  172 53.5 535
  173 1.1 11
  174 4.2 42
  184 2.7 27
  185 2.9 29
  186 0.21 2
  187 12.1 121
  188 3.1 31
  200 1.6 16
  201 0.24 2
  202 24.8 248
  203 4.2 42
//