ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007125
RECORD_TITLE: ALPHA-CEDRENE; 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$NAME: ALPHA-CEDRENE
CH$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$LINK: CAS 469-61-4
CH$LINK: INCHIKEY IRAQOCYXUMOFCW-UHFFFAOYSA-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$SPLASH: splash10-014l-9800000000-ad1af0c9dd1f9349ef88
PK$NUM_PEAK: 59
PK$PEAK: m/z int. rel.int.
  27 5.46 55
  29 5.55 56
  39 7.78 78
  41 26.47 265
  42 3.13 31
  43 5.31 53
  51 2.07 21
  53 7.64 76
  55 14.72 147
  56 11.02 110
  57 3.57 36
  65 4.65 47
  66 1.11 11
  67 5.97 60
  68 2.41 24
  69 18.39 184
  70 5 50
  77 15.08 151
  78 3.25 33
  79 10.17 102
  80 2.56 26
  81 7.91 79
  82 2.26 23
  83 1.26 13
  84 1.09 11
  91 20.02 200
  92 14.06 141
  93 45 450
  94 6.93 69
  95 3.7 37
  103 1.63 16
  105 29.69 297
  106 4.45 45
  107 5.9 59
  108 3.92 39
  109 4.93 49
  115 1.81 18
  117 2.93 29
  118 1.69 17
  119 99.99 999
  120 14.64 146
  121 13.79 138
  122 3.65 37
  123 1.86 19
  128 1.09 11
  131 1.57 16
  133 4.97 50
  134 3.58 36
  135 2.74 27
  136 7.42 74
  146 1.11 11
  147 9.09 91
  148 4.67 47
  149 1.07 11
  161 17.41 174
  162 3.45 35
  189 3.62 36
  204 20.4 204
  205 3.64 36
//