ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009901
RECORD_TITLE: 2,2,5-TRIMETHYL-1-PHENYL-4-HEXEN-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 2,2,5-TRIMETHYL-1-PHENYL-4-HEXEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H22O
CH$EXACT_MASS: 218.16707
CH$SMILES: CC(C)=CCC(C)(C)C(O)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H22O/c1-12(2)10-11-15(3,4)14(16)13-8-6-5-7-9-13/h5-10,14,16H,11H2,1-4H3
CH$LINK: INCHIKEY LHBLOKIXWZKFJL-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-300
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: splash10-0cdi-9700000000-e8f0d8cbbd8774347c23
PK$NUM_PEAK: 55
PK$PEAK: m/z int. rel.int.
  27 7 70
  28 1.3 13
  29 6.2 62
  31 2 20
  39 7.2 72
  41 40.5 405
  42 2.6 26
  43 24 240
  44 2 20
  45 2 20
  51 5 50
  53 6.9 69
  55 35.2 352
  56 18 180
  57 21 210
  58 1.8 18
  59 2 20
  67 5.3 53
  68 5 50
  69 99.7 997
  70 7.8 78
  71 6.6 66
  77 16.5 165
  78 3.5 35
  79 28.8 288
  80 2.3 23
  81 3.2 32
  83 4.5 45
  91 7.2 72
  95 7.6 76
  96 2.3 23
  97 1.5 15
  105 9.3 93
  107 99.99 999
  108 10.6 106
  110 12 120
  111 93.7 937
  112 48.8 488
  113 4.8 48
  115 2 20
  117 2.3 23
  119 2 20
  129 1.7 17
  131 4.6 46
  132 2.7 27
  133 1.4 14
  143 2 20
  147 1.6 16
  148 6.6 66
  149 8 80
  157 4.7 47
  185 3.4 34
  200 14.1 141
  201 3.7 37
  208 2 20
//
