ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010191
RECORD_TITLE: 3,4-DIBENZOYL-1-METHYL-3-PYRROLINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KANEMASA S, INST. OF ADVANCED MATERIAL STUDY KYUSHU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 3,4-DIBENZOYL-1-METHYL-3-PYRROLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C19H17NO2
CH$EXACT_MASS: 291.12593
CH$SMILES: c(c3)ccc(c3)C(=O)C(C2)=C(CN(C)2)C(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C19H17NO2/c1-20-12-16(18(21)14-8-4-2-5-9-14)17(13-20)19(22)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
CH$LINK: INCHIKEY ZCPUFQNBOLDSDB-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-01-SG-2
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: splash10-056r-9400000000-8514cfbf071a35518fa2
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  39 4.79 48
  42 11.66 117
  43 2.47 25
  44 2.33 23
  50 4.49 45
  51 24.5 245
  52 2.87 29
  53 2.64 26
  63 1.58 16
  65 1.89 19
  66 1.64 16
  75 1.47 15
  76 4.22 42
  77 99.99 999
  78 12.39 124
  79 1.67 17
  80 3.65 37
  81 3.35 34
  89 2.3 23
  105 51.86 519
  106 3.29 33
  107 1.44 14
  108 10.89 109
  113 1.07 11
  114 1.55 16
  115 7.93 79
  116 1.48 15
  127 1.38 14
  128 1.54 15
  129 2 20
  154 1.29 13
  156 1.41 14
  184 1.65 17
  186 2.85 29
  212 5.44 54
  213 1.55 16
  290 1.47 15
  291 5.28 53
  292 1.04 10
//
