ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008314
RECORD_TITLE: 1,12-DIAMINODODECANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA

CH$NAME: 1,12-DIAMINODODECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₈N₂
CH$EXACT_MASS: 200.22525
CH$SMILES: NCCCCCCCCCCCCN
CH$IUPAC: InChI=1S/C12H28N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-14H2
CH$LINK: INCHIKEY QFTYSVGGYOXFRQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2044636

AC$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-001i-9100000000-bc4a8ee49352a0c80adf
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
  18 15.8 158
  27 2.52 25
  28 1.47 15
  29 4.4 44
  30 99.99 999
  31 1.25 13
  41 9.83 98
  42 3.02 30
  43 6.03 60
  44 25.45 255
  45 6.61 66
  55 8.61 86
  56 9.17 92
  57 2.82 28
  59 3.58 36
  67 1.69 17
  68 1.24 12
  69 5.43 54
  70 4.18 42
  72 4.71 47
  73 3.04 30
  77 1.18 12
  81 1.36 14
  82 1.89 19
  83 3.12 31
  84 2.4 24
  86 5.45 55
  87 2.3 23
  96 0.68 7
  97 2.31 23
  98 1.82 18
  100 4.39 44
  101 0.83 8
  102 4.29 43
  110 0.71 7
  111 0.95 10
  112 0.96 10
  114 2.53 25
  115 0.7 7
  126 0.8 8
  128 3.86 39
  129 0.75 8
  141 0.5 5
  142 4.44 44
  143 0.68 7
  154 0.8 8
  156 5.38 54
  157 0.94 9
  166 0.43 4
  170 1.75 18
  171 8.04 80
  172 1.13 11
  182 0.7 7
  183 0.43 4
  184 5.79 58
  185 0.95 10
  199 0.68 7
  200 1.55 16
//