ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006881
RECORD_TITLE: TETRADECANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: TETRADECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₃₀
CH$EXACT_MASS: 198.23475
CH$SMILES: CCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C14H30/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-14H2,1-2H3
CH$LINK: INCHIKEY BGHCVCJVXZWKCC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1027267

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-052f-9000000000-358738bddc4a0cb69ad1
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
  27 12.54 125
  29 29.64 296
  32 1.38 14
  39 6.12 61
  41 50.89 509
  42 10.81 108
  43 99.64 996
  44 2.29 23
  53 1.79 18
  54 2.25 23
  55 21.85 219
  56 13.55 136
  57 99.99 999
  58 3.76 38
  67 1.23 12
  68 1.66 17
  69 5.42 54
  70 9.29 93
  71 53.02 530
  72 2.53 25
  83 3.36 34
  84 5.17 52
  85 31.88 319
  86 1.62 16
  97 1.52 15
  98 2.57 26
  99 5.73 57
  112 2.22 22
  113 3.34 33
  126 1.72 17
  127 2.05 21
  140 1.04 10
  141 1.52 15
  155 1.06 11
  198 3.05 31
//