ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000489
RECORD_TITLE: 5,6,7,8-TETRAHYDROISOQUINOLINE; 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$NAME: 5,6,7,8-TETRAHYDROISOQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₁N
CH$EXACT_MASS: 133.08915
CH$SMILES: C(C2)Cc(c1)c(C2)cnc1
CH$IUPAC: InChI=1S/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h5-7H,1-4H2
CH$LINK: INCHIKEY HTMGQIXFZMZZKD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40190050

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$SPLASH: splash10-001i-6900000000-a7aca15f38757288f94a
PK$NUM_PEAK: 66
PK$PEAK: m/z int. rel.int.
  15 1.5 15
  16 1.1 11
  17 5.5 55
  18 1.83 18
  26 4.8 48
  27 12.3 123
  29 3.7 37
  37 0.19 2
  38 5.7 57
  39 31.4 314
  40 3.6 36
  41 0.73 7
  42 2.1 21
  43 1.9 19
  50 13.9 139
  51 2.63 26
  52 15.6 156
  53 6 60
  54 2.9 29
  55 0.23 2
  56 1.9 19
  57 1.1 11
  58.5 1.9 19
  59 0.22 2
  61 1 10
  62 1.2 12
  63 11.8 118
  64 0.6 6
  64.5 2.6 26
  65 14.5 145
  65.5 2.8 28
  66 0.32 3
  67 2.5 25
  69 1.2 12
  73 1 10
  74 0.39 4
  75 3.8 38
  76 5.8 58
  77 21.5 215
  78 4.12 41
  79 15.6 156
  80 2.4 24
  81 1.1 11
  89 0.29 3
  90 3.6 36
  91 8.4 84
  92 6.9 69
  93 0.31 3
  102 3.3 33
  103 5.8 58
  104 19.9 199
  105 4.71 47
  106 6.9 69
  107 2.3 23
  115 2.1 21
  116 0.18 2
  117 25.5 255
  118 25.5 255
  119 7.4 74
  128 0.19 2
  129 3.6 36
  130 17.7 177
  131 6.9 69
  132 99.99 999
  133 93.3 933
  134 8.1 81
//