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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002474

N-BENZYL-3-METHYLPYRROLIDINE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002474
RECORD_TITLE: N-BENZYL-3-METHYLPYRROLIDINE; 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$NAME: N-BENZYL-3-METHYLPYRROLIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H17N
CH$EXACT_MASS: 175.13610
CH$SMILES: CC(C2)CN(C2)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C12H17N/c1-11-7-8-13(9-11)10-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3
CH$LINK: INCHIKEY MJIUUKUNEAAVEV-UHFFFAOYSA-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$SPLASH: splash10-0006-9200000000-87c2196b4bed11b83cab
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  42 99.99 999
  43 3.14 31
  51 2.89 29
  53 1.01 10
  55 6.48 65
  56 2.64 26
  57 2.22 22
  63 2.5 25
  65 15 150
  66 1.15 12
  68 1.01 10
  69 3.16 32
  77 1.77 18
  82 1.8 18
  84 44.2 442
  85 2.57 26
  89 2.67 27
  90 1.7 17
  91 92.32 923
  92 14.51 145
  97 1.3 13
  98 50.58 506
  99 3.56 36
  104 2.26 23
  105 1.19 12
  118 2.83 28
  132 9.95 100
  133 7.8 78
  174 38.94 389
  175 35.21 352
  176 4.58 46
//

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