ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006306
RECORD_TITLE: EPOXYCHRYSANTHENONE; 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$NAME: EPOXYCHRYSANTHENONE
CH$NAME: CHRYSANTHENONE EPOXIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄O₂
CH$EXACT_MASS: 166.09938
CH$SMILES: O=C(C([H])23)C([H])(C(C)(C)3)C(C)(O1)C([H])(C2)1
CH$IUPAC: InChI=1S/C10H14O2/c1-9(2)5-4-6-10(3,12-6)8(9)7(5)11/h5-6,8H,4H2,1-3H3/t5-,6-,8+,10-/m0/s1
CH$LINK: INCHIKEY MJKUEDLCFFNGOC-LVWRQZDYSA-N

AC$INSTRUMENT: HITACHI RMS-4
AC$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$SPLASH: splash10-066u-9300000000-98c33e08e98a1714acb7
PK$NUM_PEAK: 56
PK$PEAK: m/z int. rel.int.
  40 31.8 318
  41 92.2 922
  42 10.1 101
  43 7.33 73
  44 3.1 31
  45 2.3 23
  50 3.9 39
  51 1.01 10
  52 5.4 54
  53 25.2 252
  54 7 70
  55 3.57 36
  56 3.5 35
  57 2.3 23
  67 52.7 527
  68 1.55 16
  69 93 930
  70 10.9 109
  71 2.3 23
  77 1.16 12
  78 3.9 39
  79 20.5 205
  80 7.4 74
  81 1.24 12
  82 10.5 105
  83 8.5 85
  85 4.3 43
  91 4.57 46
  92 7.8 78
  93 7.4 74
  94 3.9 39
  95 1.71 17
  96 5.4 54
  97 6.6 66
  98 69.8 698
  99 6.58 66
  105 15.5 155
  106 3.5 35
  107 99.99 999
  108 1.12 11
  109 10.9 109
  110 1.2 12
  111 10.5 105
  112 0.12 1
  121 15.1 151
  122 18.3 183
  123 15.2 152
  124 0.27 3
  125 2.3 23
  137 2.3 23
  138 1.2 12
  139 0.43 4
  151 5.8 58
  165 4.7 47
  166 8.1 81
  167 1.2 12
//