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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002378

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

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002378
RECORD_TITLE: N-BENZYL-3-ETHOXYCARBONYLPYRROLIDINE; 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$NAME: N-BENZYL-3-ETHOXYCARBONYLPYRROLIDINE
CH$NAME: ETHYL 1-BENZYLPYRROLIDINE-3-CARBOXYLATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H19NO2
CH$EXACT_MASS: 233.14158
CH$SMILES: CCOC(=O)C(C2)CN(C2)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C14H19NO2/c1-2-17-14(16)13-8-9-15(11-13)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3
CH$LINK: INCHIKEY CYPXEPWPTXKUPL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60973004

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$SPLASH: splash10-0006-9400000000-2688c8fccc692b1a9bc0
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
  42 28.25 283
  43 1.9 19
  44 2.58 26
  51 2.38 24
  55 3.19 32
  65 12.66 127
  68 9.71 97
  69 2.85 29
  77 2.03 20
  82 2.25 23
  89 2.03 20
  91 99.99 999
  92 12.54 125
  114 2.42 24
  128 3.94 39
  132 6.86 69
  133 2.88 29
  142 50.16 502
  143 4.3 43
  156 9.34 93
  160 2.43 24
  184 3.07 31
  188 13.95 140
  189 1.95 20
  204 4.01 40
  229 2.96 30
  232 4.95 50
  233 5.87 59
//

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