ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010167
RECORD_TITLE: 1-METHYL-3-(PHENYLSULFONYL)PYRROLIDINE; 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$NAME: 1-METHYL-3-(PHENYLSULFONYL)PYRROLIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H15NO2S
CH$EXACT_MASS: 225.08235
CH$SMILES: CN(C2)CC(C2)S(=O)(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C11H15NO2S/c1-12-8-7-11(9-12)15(13,14)10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3
CH$LINK: INCHIKEY UOSZETBWCRGLCU-UHFFFAOYSA-N
AC$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: splash10-001i-9000000000-9036987e9a75a101dbe2
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  38 5.01 50
  40 8.57 86
  41 37.05 371
  42 3.7 37
  43 1.38 14
  50 2.1 21
  51 9.84 98
  52 1.19 12
  53 1.08 11
  55 5.23 52
  56 1.4 14
  57 5.05 51
  58 1.9 19
  65 1.15 12
  67 4.25 43
  68 1.39 14
  71 1.23 12
  77 14.68 147
  78 2.49 25
  81 1.36 14
  82 44.78 448
  83 99.99 999
  84 12.27 123
  91 1.04 10
  109 1.05 11
  225 3.41 34
  226 1.02 10
//
