ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010678
RECORD_TITLE: GERMACRENE-B; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: EGUCHI S, FAC. OF SCIENCE, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: GERMACRENE-B
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₄
CH$EXACT_MASS: 204.18780
CH$SMILES: CC(=C1)CCC(CC=C(C)CC1)=C(C)C
CH$IUPAC: InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3/b13-6+,14-9-
CH$LINK: INCHIKEY GXEGJTGWYVZSNR-JEKCHIPQSA-N

AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-0006-9500000000-e387782d579e0e7098eb
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
  41 99.99 999
  42 17.3 173
  43 28.2 282
  51 1.64 16
  52 13.2 132
  53 71.4 714
  54 7.7 77
  55 4.73 47
  56 8.6 86
  57 9.6 96
  63 9.1 91
  65 2.82 28
  66 12.7 127
  67 68.3 683
  68 24.6 246
  69 1.96 20
  77 51 510
  78 14.6 146
  79 54.6 546
  80 1.73 17
  81 43.7 437
  82 9.6 96
  83 10 100
  85 0.77 8
  91 61 610
  92 16.4 164
  93 82.8 828
  94 1.55 16
  95 15.9 159
  103 10 100
  105 57.3 573
  106 1.73 17
  107 46.9 469
  108 20.9 209
  109 13.7 137
  115 1.09 11
  117 11.8 118
  119 35.5 355
  120 95.6 956
  121 6.96 70
  122 28.7 287
  123 10 100
  128 7.3 73
  129 0.73 7
  131 8.6 86
  133 28.7 287
  134 11.8 118
  135 1.09 11
  136 9.6 96
  140 8.6 86
  147 20.9 209
  148 1.23 12
  149 9.1 91
  161 30 300
  162 10 100
  189 1.64 16
  204 27.3 273
  205 7.7 77
//