MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002101

ANILINE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002101
RECORD_TITLE: 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

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CH$NAME: ANILINE
CH$NAME: AMINOBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₇N
CH$EXACT_MASS: 93.05785
CH$SMILES: Nc(c1)cccc1
CH$IUPAC: InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2
CH$LINK: INCHIKEY PAYRUJLWNCNPSJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8020090

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-00kf-9000000000-9a543eee5081cc927e82
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  27 1.51 15
  37 1.8 18
  38 3.6 36
  39 10.66 107
  40 4.32 43
  41 3.96 40
  45.5 1.51 15
  46.5 4.68 47
  50 2.74 27
  51 3.24 32
  52 3.46 35
  53 1.44 14
  54 3.46 35
  62 2.09 21
  63 3.67 37
  64 2.59 26
  65 18.01 180
  66 42.44 424
  67 4.32 43
  77 1.37 14
  78 1.51 15
  92 11.53 115
  93 99.99 999
  94 6.7 67
//