MassBank Record: JP003982

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ANILINE; EI-B; MS

Mass Spectrum
Chemical Structure
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ACCESSION: JP003982
RECORD_TITLE: ANILINE; 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$NAME: Aniline
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H7N
CH$EXACT_MASS: 93.057850000000001955413608811795711517333984375
CH$SMILES: Nc(c1)cccc1
CH$IUPAC: InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2
CH$LINK: COMPTOX DTXSID8020090
CH$LINK: INCHIKEY PAYRUJLWNCNPSJ-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-0006-9000000000-e04550d3cafee77e6192
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  15 1 10
  26 2.1 21
  27 2.5 25
  28 0.76 8
  37 3 30
  38 6.9 69
  39 16.7 167
  40 0.53 5
  41 5.2 52
  42 2.1 21
  45 1.9 19
  47 0.78 8
  50 3 30
  51 4.5 45
  52 4.5 45
  53 0.19 2
  54 4.9 49
  61 1.8 18
  62 2.9 29
  63 0.38 4
  64 2 20
  65 18.2 182
  66 32.6 326
  67 0.41 4
  74 2 20
  76 1.5 15
  77 1.5 15
  78 0.13 1
  91 1.8 18
  92 10 100
  93 99.99 999
  94 5.7 57
//