ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002387
RECORD_TITLE: N-BENZYL-TRANS-(3-ACETYL-4-PHENYL)PYRROLIDINE; 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$NAME: N-BENZYL-TRANS-(3-ACETYL-4-PHENYL)PYRROLIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₂₁NO
CH$EXACT_MASS: 279.16231
CH$SMILES: CC(=O)C(C2)C(CN(Cc(c3)cccc3)2)c(c1)cccc1
CH$IUPAC: InChI=1S/C19H21NO/c1-15(21)18-13-20(12-16-8-4-2-5-9-16)14-19(18)17-10-6-3-7-11-17/h2-11,18-19H,12-14H2,1H3/t18-,19-/m1/s1
CH$LINK: INCHIKEY XUMMZAHZYIBFES-RTBURBONSA-N

AC$INSTRUMENT: JEOL JMS-D-3000
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9710000000-923c9c0d72935fbd3af2
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  42 63.42 634
  43 19.33 193
  51 4.33 43
  65 15.26 153
  77 5.47 55
  91 99.99 999
  92 8.84 88
  104 5.74 57
  105 3.41 34
  115 10.8 108
  116 4.21 42
  117 50.67 507
  118 7.96 80
  132 16.18 162
  133 11.31 113
  144 4.11 41
  158 3.41 34
  160 8.3 83
  175 32.46 325
  176 4.67 47
  188 8.69 87
  209 14.46 145
  260 3.63 36
  279 18.48 185
  280 3.94 39
//