ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001948
RECORD_TITLE: 2,4,4-TRIMETHYL-6-METHYLENEOCT-7-EN-3-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 2,4,4-TRIMETHYL-6-METHYLENEOCT-7-EN-3-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H20O
CH$EXACT_MASS: 180.15142
CH$SMILES: C=CC(=C)CC(C)(C)C(=O)C(C)C
CH$IUPAC: InChI=1S/C12H20O/c1-7-10(4)8-12(5,6)11(13)9(2)3/h7,9H,1,4,8H2,2-3,5-6H3
CH$LINK: INCHIKEY SBYFNTNCYJALMR-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-3000
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: splash10-001i-9100000000-7df6bd05557d8eb42e02
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  41 31.78 318
  42 4.53 45
  43 11.73 117
  53 7.37 74
  55 13.36 134
  56 3.14 31
  57 9.59 96
  66 4.16 42
  67 16.53 165
  68 9.63 96
  69 34.29 343
  70 4.88 49
  77 3.16 32
  79 3.87 39
  81 10.55 106
  83 5.73 57
  84 99.99 999
  85 9.84 98
  91 2.93 29
  94 5.6 56
  95 14.8 148
  96 13.52 135
  107 4.46 45
  109 9.67 97
  121 2.9 29
  123 4.4 44
  124 6.81 68
  125 8.83 88
  163 3.52 35
  180 18.06 181
//
