ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007354
RECORD_TITLE: 1,6-HEXANEDIAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 1,6-HEXANEDIAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H16N2
CH$EXACT_MASS: 116.13135
CH$SMILES: NCCCCCCN
CH$IUPAC: InChI=1S/C6H16N2/c7-5-3-1-2-4-6-8/h1-8H2
CH$LINK: CAS 124-09-4
CH$LINK: INCHIKEY NAQMVNRVTILPCV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5024922
AC$INSTRUMENT: HITACHI RMU-6M
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: splash10-001i-9000000000-85f5487a61acc057e55c
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  18 6.54 65
  27 1.9 19
  28 4.86 49
  29 1.39 14
  30 99.99 999
  31 3.75 38
  39 1.76 18
  41 4.03 40
  42 4.31 43
  43 3.24 32
  44 5.24 52
  45 5.14 51
  55 2.69 27
  56 13.53 135
  57 1.07 11
  58 2.78 28
  69 1.71 17
  70 2.74 27
  72 2.41 24
  73 1.39 14
  86 4.26 43
  87 8.95 90
  100 5.93 59
  101 2.87 29
//
