ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002825
RECORD_TITLE: ALPHA-CEDRENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: ALPHA-CEDRENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₄
CH$EXACT_MASS: 204.18780
CH$SMILES: CC(=C3)C(C1)C(C)(C)C(C2)C(C3)(C(C)C2)1
CH$IUPAC: InChI=1S/C15H24/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h7,11-13H,5-6,8-9H2,1-4H3
CH$LINK: INCHIKEY IRAQOCYXUMOFCW-UHFFFAOYSA-N

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-014l-9700000000-d2cf39389a4a1797b084
PK$NUM_PEAK: 84
PK$PEAK: m/z int. rel.int.
  27 6 60
  29 6.1 61
  39 7.5 75
  40 0.12 1
  41 28 280
  42 2.2 22
  43 5.8 58
  51 0.21 2
  52 1 10
  53 7.6 76
  54 1 10
  55 1.51 15
  56 12 120
  57 5 50
  63 0.8 8
  64 0.05 1
  65 4.6 46
  66 1.2 12
  67 6.6 66
  68 0.25 3
  69 23.5 235
  70 5.2 52
  71 1.3 13
  75 0.05 1
  77 14.7 147
  78 3.2 32
  79 10.2 102
  80 0.03 0
  81 8.3 83
  82 3.5 35
  83 2 20
  84 0.13 1
  89 1 10
  90 0.6 6
  91 19.8 198
  92 0.15 2
  93 50.5 505
  94 7.8 78
  95 4.6 46
  96 0.12 1
  97 1.5 15
  103 1.8 18
  104 1 10
  105 3.05 31
  106 4.7 47
  107 6.5 65
  108 4.5 45
  109 0.06 1
  110 1 10
  112 0.5 5
  115 2.5 25
  116 0.11 1
  117 2.7 27
  118 2.5 25
  119 99.99 999
  120 1.57 16
  121 15 150
  122 4 40
  123 2.6 26
  124 0.01 0
  128 1 10
  129 1 10
  130 0.5 5
  131 0.15 2
  132 0.6 6
  133 5.8 58
  134 3.7 37
  135 0.28 3
  136 7.5 75
  137 0.8 8
  145 0.8 8
  146 0.11 1
  147 9 90
  148 4.3 43
  149 1.1 11
  160 0.06 1
  161 20 200
  162 3.7 37
  163 0.5 5
  175 0.08 1
  189 3.2 32
  190 0.5 5
  204 18.7 187
  205 3.3 33
//