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MassBank Record: JP002885

1,10-DICYANO-DECANE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP002885
RECORD_TITLE: 1,10-DICYANO-DECANE; 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$NAME: 1,10-DICYANO-DECANE
CH$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$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001j-9000000000-18698ec69f970b0e890a
PK$NUM_PEAK: 41
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
  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
  109 3.78 38
  110 32.14 321
  111 6.11 61
  124 9.1 91
  138 2.83 28
  149 2.79 28
  152 16.82 168
  153 2.39 24
  163 4.28 43
  191 2.29 23
//

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