ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001964
RECORD_TITLE: 2,4,4-TRIMETHYLHEPT-6-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$NAME: 2,4,4-TRIMETHYLHEPT-6-EN-3-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: C=CCC(C)(C)C(=O)C(C)C
CH$IUPAC: InChI=1S/C10H18O/c1-6-7-10(4,5)9(11)8(2)3/h6,8H,1,7H2,2-5H3
CH$LINK: INCHIKEY UCARIABCKZAQBN-UHFFFAOYSA-N
AC$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: splash10-053u-9100000000-fa87252b0987d90094be
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  41 31.76 318
  42 4.14 41
  43 55.63 556
  53 2.68 27
  55 77.99 780
  56 4.38 44
  65 1.89 19
  67 9.56 96
  69 4.1 41
  70 5.25 53
  71 52.78 528
  72 2.96 30
  73 3.71 37
  75 1.97 20
  82 22.28 223
  83 99.99 999
  84 7.26 73
  111 32.91 329
  112 2.56 26
  117 1.77 18
  118 1.77 18
  131 5.72 57
  139 1.89 19
  154 24.89 249
  155 2.92 29
//
