ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005045
RECORD_TITLE: 2-(4-METHYLBENZOYL)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$NAME: 2-(4-METHYLBENZOYL)INDOLE
CH$NAME: 2-INDOLYL P-TOLYL KETONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H13NO
CH$EXACT_MASS: 235.09971
CH$SMILES: CC1=CC=C(C=C1)C(=O)C2=CC3=CC=CC=C3N2
CH$IUPAC: InChI=1S/C16H13NO/c1-11-6-8-12(9-7-11)16(18)15-10-13-4-2-3-5-14(13)17-15/h2-10,17H,1H3
CH$LINK: INCHIKEY ABJJWHBJUVWQEX-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$SPLASH: splash10-000i-2390000000-d5ec1112637cb48ca24f
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  39 4 40
  41 1.2 12
  63 5 50
  65 1.74 17
  88 1.2 12
  89 40 400
  90 6.6 66
  91 4.27 43
  92 1.9 19
  103.5 4.4 44
  115 9.6 96
  116 0.86 9
  116.5 1.2 12
  117 1.4 14
  119 29.3 293
  143 3.07 31
  144 34.7 347
  145 1.3 13
  191 1.2 12
  204 0.17 2
  206 3.3 33
  207 5.9 59
  218 8.1 81
  219 0.57 6
  220 48 480
  221 7.1 71
  234 14.7 147
  235 99.99 999
  236 18.7 187
//
