ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009148
RECORD_TITLE: CEDROL; 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$NAME: CEDROL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₆O
CH$EXACT_MASS: 222.19837
CH$SMILES: [H]C(C)(C3)C(C2)(C1)C(C3)C(C)(C)C([H])(C(C)(O)C2)1
CH$IUPAC: InChI=1S/C15H26O/c1-10-5-6-11-13(2,3)12-9-15(10,11)8-7-14(12,4)16/h10-12,16H,5-9H2,1-4H3/t10-,11?,12-,14-,15?/m1/s1
CH$LINK: INCHIKEY SVURIXNDRWRAFU-OWAXCYOXSA-N

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$SPLASH: splash10-0f6y-9600000000-bdf6fee547e3ab6e28dc
PK$NUM_PEAK: 95
PK$PEAK: m/z int. rel.int.
  15 1.36 14
  18 1.98 20
  27 9.06 91
  29 13.47 135
  39 12.06 121
  41 58.88 589
  42 5.54 55
  43 61.58 616
  44 2.43 24
  45 3.76 38
  51 2.54 25
  52 1.76 18
  53 14.02 140
  54 3.04 30
  55 32.56 326
  56 4.48 45
  57 5.73 57
  58 7.67 77
  59 6.05 61
  65 6.38 64
  66 2.78 28
  67 20.54 205
  68 3.82 38
  69 39.37 394
  70 2.85 29
  71 14.86 149
  72 8.99 90
  73 1.39 14
  77 17.19 172
  78 4.34 43
  79 25.79 258
  80 4.91 49
  81 42.36 424
  82 10.83 108
  83 7.23 72
  84 1.7 17
  85 1 10
  91 21.63 216
  92 5.05 51
  93 32.35 324
  94 8.96 90
  95 99.99 999
  96 9.88 99
  97 3.39 34
  99 7.65 77
  103 1.48 15
  104 1.24 12
  105 16.31 163
  106 4.54 45
  107 27.99 280
  108 15.58 156
  109 25 250
  110 3.29 33
  111 2.76 28
  113 1.36 14
  115 1.54 15
  117 1.89 19
  119 18.86 189
  120 5.46 55
  121 20.42 204
  122 12.05 121
  123 9.83 98
  124 1.48 15
  131 1.2 12
  133 9.22 92
  134 3.88 39
  135 20.38 204
  136 4.79 48
  137 6.25 63
  138 1.95 20
  139 1.04 10
  147 7.19 72
  148 3.52 35
  149 17.11 171
  150 75.7 757
  151 71.26 713
  152 8.66 87
  161 12.71 127
  162 3.1 31
  163 2.96 30
  164 7.11 71
  165 9.82 98
  166 3.87 39
  167 1.65 17
  175 1.11 11
  177 4.66 47
  178 2.46 25
  179 2.92 29
  189 4.2 42
  193 1.5 15
  204 5.95 60
  205 1.07 11
  207 13.31 133
  208 2.53 25
  222 3.53 35
//