ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000785
RECORD_TITLE: 9H-PYRIDO(3,4-B)INDOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 9H-PYRIDO(3,4-B)INDOLE
CH$NAME: N0RHARMAN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₈N₂
CH$EXACT_MASS: 168.06875
CH$SMILES: C1=CC=C2C(=C1)C3=C(N2)C=NC=C3
CH$IUPAC: InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H
CH$LINK: INCHIKEY AIFRHYZBTHREPW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2021070

AC$INSTRUMENT: VARIAN MAT-44S
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-014i-5900000000-3480c725264b958ffc7f
PK$NUM_PEAK: 66
PK$PEAK: m/z int. rel.int.
  41 4.53 45
  42 1.56 16
  43 4.53 45
  44 5.94 59
  45 1.56 16
  50 5.37 54
  51 5.94 59
  52 3.11 31
  55 3.82 38
  56 3.68 37
  57 7.36 74
  61 2.83 28
  62 7.64 76
  63 12.59 126
  64 4.1 41
  65 2.55 26
  66 1.13 11
  67 1.41 14
  69 2.26 23
  70 10.04 100
  71 1.27 13
  73 1.7 17
  74 4.95 50
  75 0.58 6
  76 3.68 37
  77 3.39 34
  78 1.27 13
  83 2.26 23
  84 19.52 195
  85 3.82 38
  86 4.24 42
  87 6.08 61
  88 8.2 82
  89 4.1 41
  90 2.97 30
  91 1.84 18
  98 1.27 13
  99 1.41 14
  100 1.41 14
  101 0.24 2
  102 1.84 18
  110 1.13 11
  111 1.27 13
  112 1.98 20
  113 15.84 158
  114 23.06 231
  115 7.07 71
  116 1.84 18
  117 4.24 42
  127 1.56 16
  128 4.95 50
  129 1.27 13
  138 1.41 14
  139 4.24 42
  140 32.11 321
  141 14.71 147
  142 4.67 47
  143 1.27 13
  154 1.27 13
  166 2.12 21
  167 11.74 117
  168 99.99 999
  169 13.44 134
  170 2.83 28
  181 1.13 11
  182 3.11 31
//