ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008692
RECORD_TITLE: TETRADECANAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: TETRADECANAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₈O
CH$EXACT_MASS: 212.21402
CH$SMILES: CCCCCCCCCCCCCC=O
CH$IUPAC: InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h14H,2-13H2,1H3
CH$LINK: INCHIKEY UHUFTBALEZWWIH-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1021665

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$SPLASH: splash10-0536-9000000000-e2a96717d418d3033297
PK$NUM_PEAK: 62
PK$PEAK: m/z int. rel.int.
  20 1.02 10
  26 1.49 15
  27 16.68 167
  29 41.49 415
  31 1.54 15
  39 11.16 112
  41 92.9 929
  42 14.88 149
  43 99.99 999
  44 35.38 354
  45 11.17 112
  53 4.68 47
  54 11.84 118
  55 72.85 729
  56 31.58 316
  57 84.32 843
  58 4.52 45
  59 1.31 13
  65 1.16 12
  66 6.1 61
  67 37.07 371
  68 49.72 497
  69 42.98 430
  70 19.05 191
  71 31.59 316
  72 6.09 61
  73 1.05 11
  79 2.24 22
  80 1.91 19
  81 28.46 285
  82 68.43 684
  83 38.18 382
  84 12.51 125
  85 11.35 114
  86 2.21 22
  93 1.23 12
  94 1.92 19
  95 19.36 194
  96 38.48 385
  97 16.35 164
  98 6.65 67
  99 4.13 41
  109 9.89 99
  110 9.34 93
  111 7.28 73
  112 4.1 41
  113 1.56 16
  123 4.84 48
  124 6.73 67
  125 3.87 39
  126 2.4 24
  137 3.97 40
  138 4.66 47
  139 1.73 17
  140 2.05 21
  151 1.55 16
  152 2.03 20
  166 4.22 42
  168 5.89 59
  169 1.13 11
  184 1.1 11
  194 2.09 21
//