ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008317
RECORD_TITLE: N-NONYL CYANIDE; 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$NAME: N-NONYL CYANIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₉N
CH$EXACT_MASS: 153.15175
CH$SMILES: CCCCCCCCCC#N
CH$IUPAC: InChI=1S/C10H19N/c1-2-3-4-5-6-7-8-9-10-11/h2-9H2,1H3
CH$LINK: COMPTOX DTXSID9027449
CH$LINK: INCHIKEY HBZDPWBWBJMYRY-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:74791

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$SPLASH: splash10-000y-9000000000-e84c6f9d6b16cb7c971d
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  27 34.76 348
  28 6.85 69
  29 50.48 505
  39 21.71 217
  41 99.99 999
  42 32.91 329
  43 69.07 691
  53 2.98 30
  54 59.77 598
  55 28.51 285
  56 13.55 136
  57 55.59 556
  67 10.51 105
  68 13.68 137
  69 58.82 588
  70 15.64 156
  71 11.48 115
  79 0.77 8
  80 1.09 11
  81 5.8 58
  82 73.77 738
  83 70.29 703
  84 10.91 109
  93 6.34 63
  95 3.44 34
  96 78.32 783
  97 53.78 538
  98 6.21 62
  109 5.17 52
  110 44.58 446
  111 20.16 202
  124 10.99 110
  138 3.49 35
//