ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006866
RECORD_TITLE: DODECANOL; 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$NAME: DODECANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₆O
CH$EXACT_MASS: 186.19837
CH$SMILES: CCCCCCCCCCCCO
CH$IUPAC: InChI=1S/C12H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h13H,2-12H2,1H3
CH$LINK: INCHIKEY LQZZUXJYWNFBMV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5026918

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$SPLASH: splash10-0a4l-9000000000-0265898e793080c75dbb
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  15 1.06 11
  27 20.53 205
  29 44.87 449
  30 1.13 11
  31 39.1 391
  39 15.66 157
  40 1.75 18
  41 89.53 895
  42 32.27 323
  43 96.45 965
  44 3.67 37
  45 2.75 28
  53 5.53 55
  54 8.16 82
  55 99.99 999
  56 71.97 720
  57 59.91 599
  58 3.17 32
  67 9.47 95
  68 29.7 297
  69 76.3 763
  70 67.25 673
  71 16.24 162
  72 1.19 12
  73 2.2 22
  81 3.45 35
  82 21.68 217
  83 60.85 609
  84 39.18 392
  85 8.65 87
  96 5.95 60
  97 37.42 374
  98 18.75 188
  99 2.03 20
  110 2.49 25
  111 15.46 155
  112 9.61 96
  124 1.04 10
  125 4.69 47
  126 2.66 27
  139 1.72 17
  140 7.9 79
  141 1.7 17
  168 2.11 21
//