ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005380
RECORD_TITLE: (Z)-3-DODECEN-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAOKA R, KYOTO INSTITUTE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: (Z)-3-DODECEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₄O
CH$EXACT_MASS: 184.18272
CH$SMILES: CCCCCCCCC([H])=C([H])CCO
CH$IUPAC: InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h9-10,13H,2-8,11-12H2,1H3/b10-9-
CH$LINK: INCHIKEY BDGQTWOHKASHQU-KTKRTIGZSA-N
CH$LINK: COMPTOX DTXSID40885535

AC$INSTRUMENT: SHIMADZU QP-1000
AC$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$SPLASH: splash10-00kf-9000000000-69e659b42c5575782ccf
PK$NUM_PEAK: 57
PK$PEAK: m/z int. rel.int.
  40 1.2 12
  41 32.4 324
  42 5.9 59
  43 99.99 999
  44 66.2 662
  45 9 90
  46 5.1 51
  51 0.1 1
  52 2.8 28
  53 1.4 14
  54 35 350
  55 8.13 81
  56 24.1 241
  57 38.1 381
  58 2.8 28
  65 0.32 3
  66 6 60
  67 53.1 531
  68 69.3 693
  69 3.59 36
  70 14.6 146
  71 10.1 101
  72 1.2 12
  77 0.29 3
  78 1.9 19
  79 7.5 75
  81 39.1 391
  82 3.82 38
  83 18.2 182
  84 5.2 52
  85 3.4 34
  91 0.26 3
  92 3 30
  93 1.2 12
  95 19.3 193
  96 2.03 20
  97 9.9 99
  98 3 30
  99 1.1 11
  103 0.11 1
  105 1.8 18
  109 10.9 109
  110 11.4 114
  111 0.38 4
  112 1.5 15
  116 1.2 12
  117 1.2 12
  123 0.54 5
  124 5.6 56
  125 1 10
  133 1.4 14
  134 0.34 3
  137 2.8 28
  138 6 60
  149 1.7 17
  166 0.47 5
  167 1.3 13
//