ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006628
RECORD_TITLE: 3,6-DIACETYL-9-PROPYLCARBAZOLE; 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$NAME: 3,6-DIACETYL-9-PROPYLCARBAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C19H19NO2
CH$EXACT_MASS: 293.14158
CH$SMILES: CCCn(c21)c(c3)c(cc(C(C)=O)c3)c(cc(C(C)=O)cc2)1
CH$IUPAC: InChI=1S/C19H19NO2/c1-4-9-20-18-7-5-14(12(2)21)10-16(18)17-11-15(13(3)22)6-8-19(17)20/h5-8,10-11H,4,9H2,1-3H3
CH$LINK: INCHIKEY IAFSDNNCEQCMLQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40347486
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$SPLASH: splash10-01t9-2190000000-2603b8bfb20667beb11e
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  39 2 20
  41 7.8 78
  42 1.4 14
  43 2.57 26
  44 14.5 145
  45 7.6 76
  55 5 50
  56 0.12 1
  57 7.3 73
  60 1.4 14
  67 1.1 11
  69 0.41 4
  70 1.1 11
  71 2.7 27
  73 1.3 13
  77 0.1 1
  78 5.2 52
  81 1.2 12
  82 1.1 11
  83 0.25 3
  84 1 10
  85 1.2 12
  97 1.7 17
  125 0.11 1
  131.5 7.8 78
  139 1 10
  151 2.9 29
  152 0.14 1
  164 4.8 48
  165 2.6 26
  177 1.7 17
  178 1.06 11
  179 4.5 45
  180 1.4 14
  191 1 10
  192 0.3 3
  193 4.7 47
  220 3.3 33
  221 31.3 313
  222 0.63 6
  235 4.8 48
  236 1.8 18
  250 1.2 12
  264 99.99 999
  265 15.3 153
  278 91.7 917
  279 13.8 138
  293 7.92 79
  294 13.4 134
//
