ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007126
RECORD_TITLE: LONGIFOLENE; 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$NAME: LONGIFOLENE
CH$NAME: DECAHYDRO-4,8,8-TRIMETHYL-9-METHYLENE-1,4-METHANOAZULENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₄
CH$EXACT_MASS: 204.18780
CH$SMILES: CC(C)(C2)C(C31)C(CC3)C(C)(CC2)C(=C)1
CH$IUPAC: InChI=1S/C15H24/c1-10-11-6-7-12-13(11)14(2,3)8-5-9-15(10,12)4/h11-13H,1,5-9H2,2-4H3/t11?,12?,13-,15+/m0/s1
CH$LINK: CAS 475-20-7
CH$LINK: INCHIKEY PDSNLYSELAIEBU-NSOJWWLLSA-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$SPLASH: splash10-052f-9700000000-e353fe7ae8dde0511983
PK$NUM_PEAK: 87
PK$PEAK: m/z int. rel.int.
  15 1.71 17
  27 20.57 206
  28 4.3 43
  29 30.43 304
  39 40.45 405
  40 4.76 48
  41 99.99 999
  42 6.64 66
  43 15.78 158
  50 1.82 18
  51 9.8 98
  52 4.83 48
  53 24.23 242
  54 3.8 38
  55 55.39 554
  56 7.72 77
  57 5.72 57
  63 3.36 34
  64 2.05 21
  65 19.4 194
  66 6.48 65
  67 40.45 405
  68 4.06 41
  69 23.53 235
  70 2.36 24
  71 1.65 17
  77 41.82 418
  78 10.28 103
  79 60.95 610
  80 10.21 102
  81 35.55 356
  82 13.71 137
  83 8.19 82
  89 1.63 16
  91 94.02 940
  92 23.04 230
  93 68.14 681
  94 77.46 775
  95 56.66 567
  96 7.4 74
  97 2.66 27
  103 6.67 67
  104 4.36 44
  105 74.22 742
  106 25.15 252
  107 68.4 684
  108 42.12 421
  109 45.31 453
  110 5.53 55
  111 3.41 34
  115 8.49 85
  116 3.33 33
  117 10.91 109
  118 3.2 32
  119 49.97 500
  120 20.92 209
  121 34.53 345
  122 16.38 164
  123 7.98 80
  128 3.4 34
  129 3.42 34
  130 1.84 18
  131 6.5 65
  132 2.56 26
  133 45.36 454
  134 18.69 187
  135 44.04 440
  136 10.77 108
  137 7.64 76
  138 1.93 19
  145 4.07 41
  146 1.52 15
  147 24.2 242
  148 12.61 126
  149 5.57 56
  150 2.47 25
  159 1.31 13
  161 91.08 911
  162 14.98 150
  163 7.28 73
  175 12.78 128
  176 6.53 65
  177 1.13 11
  189 48.04 480
  190 6.03 60
  204 37.51 375
  205 5.28 53
//