ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004345
RECORD_TITLE: 2-PHENYLINDOLE; 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$NAME: 2-PHENYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H11N
CH$EXACT_MASS: 193.08915
CH$SMILES: C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2
CH$IUPAC: InChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H
CH$LINK: CAS 948-65-2
CH$LINK: INCHIKEY KLLLJCACIRKBDT-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8061343
AC$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: splash10-0006-6900000000-a7129403da1c9cf841b8
PK$NUM_PEAK: 72
PK$PEAK: m/z int. rel.int.
  26 2.8 28
  27 5.9 59
  29 3 30
  30 0.11 1
  31 1 10
  39 2 20
  40 2.4 24
  41 0.66 7
  42 2.2 22
  43 4.3 43
  50 1.6 16
  51 0.43 4
  52 1.4 14
  54 1.1 11
  55 4.6 46
  56 0.2 2
  57 3.7 37
  60 1.4 14
  62 1.7 17
  63 0.2 2
  64 2.2 22
  65 1.7 17
  67 2.1 21
  69 0.26 3
  70 1.4 14
  70.5 1.5 15
  71 1.7 17
  73 0.11 1
  75 1.5 15
  76 1.7 17
  77 4.3 43
  78 0.12 1
  79 1.1 11
  81 1.8 18
  82 2.5 25
  82.5 0.21 2
  83 1.9 19
  83.5 6.1 61
  84 1.5 15
  87 0.14 1
  88 1.5 15
  89 17.3 173
  90 14.7 147
  91 0.32 3
  95 1.2 12
  95.5 4.6 46
  96 1.6 16
  96.5 0.96 10
  97 2.2 22
  98 1.1 11
  102 1.2 12
  113 0.14 1
  114 1.5 15
  115 3.5 35
  116 1.1 11
  117 0.12 1
  126 1.1 11
  127 1 10
  139 4 40
  140 0.21 2
  152 1.1 11
  163 4.4 44
  164 5 50
  165 3.02 30
  166 6.9 69
  167 2.8 28
  190 5.5 55
  191 0.71 7
  192 15.5 155
  193 99.99 999
  194 16.9 169
  195 1.4 14
//
