ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001299
RECORD_TITLE: PARA-PHENYLENEDIAMINE; 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$NAME: PARA-PHENYLENEDIAMINE
CH$NAME: PARA-DIAMINOBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₈N₂
CH$EXACT_MASS: 108.06875
CH$SMILES: Nc(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C6H8N2/c7-5-1-2-6(8)4-3-5/h1-4H,7-8H2
CH$LINK: INCHIKEY CBCKQZAAMUWICA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9021138

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$SPLASH: splash10-0a4i-8900000000-5b42adf83e422cffefb6
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  27 2.32 23
  28 5.54 55
  38 1.02 10
  39 2.83 28
  40 1.87 19
  41 3.11 31
  42 1.58 16
  50 1.13 11
  51 2.15 22
  52 7.52 75
  53 11.99 120
  53.5 1.41 14
  54 12.1 121
  55 1.81 18
  63 1.98 20
  64 2.26 23
  65 2.21 22
  66 1.3 13
  67 2.49 25
  78 1.02 10
  79 1.81 18
  80 33.88 339
  81 15.27 153
  82 1.47 15
  90 1.19 12
  91 2.83 28
  105 1.07 11
  106 1 10
  107 25.4 254
  108 99.99 999
  109 6.79 68
//