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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002118

N-ETHYL ANILINE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002118
RECORD_TITLE: N-ETHYL ANILINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: N-ETHYL ANILINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H11N
CH$EXACT_MASS: 121.08915
CH$SMILES: CCNc(c1)cccc1
CH$IUPAC: InChI=1S/C8H11N/c1-2-9-8-6-4-3-5-7-8/h3-7,9H,2H2,1H3
CH$LINK: INCHIKEY OJGMBLNIHDZDGS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1025271

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0a4i-6900000000-d449b83fa832bf7a9b12
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
  27 3.3 33
  28 3.64 36
  29 1.28 13
  30 2.02 20
  38 1.75 18
  39 6.68 67
  40 1.35 14
  41 1.48 15
  42 2.09 21
  44 1.96 20
  50 3.24 32
  51 13.01 130
  52 4.32 43
  53 7.96 80
  58.5 1.21 12
  63 2.56 26
  64 2.09 21
  65 7.75 78
  66 3.17 32
  77 26.57 266
  78 5.39 54
  79 16.25 163
  80 1.35 14
  91 2.9 29
  92 2.02 20
  93 1.89 19
  103 1.55 16
  104 3.44 34
  106 99.99 999
  107 8.02 80
  118 2.63 26
  119 1.48 15
  120 5.39 54
  121 37.09 371
  122 4.05 41
//

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