ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008316
RECORD_TITLE: 1,10-DICYANODECANE; 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$NAME: 1,10-DICYANODECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₀N₂
CH$EXACT_MASS: 192.16265
CH$SMILES: N#CCCCCCCCCCCC#N
CH$IUPAC: InChI=1S/C12H20N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-10H2
CH$LINK: INCHIKEY AVQYXBDAZWIFTO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00196513

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$SPLASH: splash10-001j-9100000000-0cb68a64a6f638730839
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
  27 23.86 239
  28 10.72 107
  29 29.05 291
  39 20.15 202
  40 4.72 47
  41 83.31 833
  42 18.3 183
  43 20.04 200
  53 9.08 91
  54 38.64 386
  55 61.89 619
  56 10.94 109
  57 11.86 119
  67 11.55 116
  68 10.13 101
  69 52.87 529
  70 7.08 71
  77 3.52 35
  79 7.02 70
  80 4.05 41
  81 11.41 114
  82 70.51 705
  83 99.99 999
  84 8.5 85
  91 1.76 18
  93 3.74 37
  94 2.51 25
  95 5.77 58
  96 62.81 628
  97 94.97 950
  98 8.85 89
  107 2.5 25
  108 1.95 20
  109 3.78 38
  110 32.14 321
  111 6.11 61
  122 1.59 16
  124 9.1 91
  135 1.74 17
  138 2.83 28
  141 1.04 10
  142 1.05 11
  149 2.79 28
  152 16.82 168
  153 2.39 24
  163 4.28 43
  171 0.11 1
  191 2.29 23
//