ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009750
RECORD_TITLE: 4,4A,5,6,7,8-HEXAHYDRO-4A-METHYL-2(3H)-NAPHTHALENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 4,4A,5,6,7,8-HEXAHYDRO-4A-METHYL-2(3H)-NAPHTHALENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H16O
CH$EXACT_MASS: 164.12012
CH$SMILES: O=C(C1)C=C(C2)C(C)(CCC2)C1
CH$IUPAC: InChI=1S/C11H16O/c1-11-6-3-2-4-9(11)8-10(12)5-7-11/h8H,2-7H2,1H3
CH$LINK: INCHIKEY OHERZLWVBJCXOF-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-022i-3900000000-6cba91f76ed62cca88e7
PK$NUM_PEAK: 54
PK$PEAK: m/z int. rel.int.
  28 8.4 84
  29 1.5 15
  41 3.2 32
  43 0.16 2
  45 1.3 13
  53 2.3 23
  54 1.1 11
  55 0.52 5
  65 1.2 12
  66 1.7 17
  67 8.6 86
  68 0.29 3
  69 1.6 16
  77 2.1 21
  79 27.5 275
  81 1.36 14
  82 6 60
  83 3.5 35
  91 8.8 88
  92 0.32 3
  93 27.5 275
  94 16.2 162
  95 6 60
  96 0.16 2
  97 1.5 15
  105 4.5 45
  106 2 20
  107 4.89 49
  108 23.9 239
  109 4.8 48
  110 1.9 19
  117 0.15 2
  118 2.1 21
  119 1.3 13
  120 1.9 19
  121 4.61 46
  122 99.99 999
  123 11.6 116
  124 1.2 12
  128 0.12 1
  131 3.2 32
  133 1.3 13
  134 1.3 13
  135 1.11 11
  136 85.9 859
  137 9.9 99
  138 1.6 16
  145 0.11 1
  146 2.5 25
  149 13.5 135
  150 1.5 15
  163 0.11 1
  164 88.7 887
  165 11.6 116
//
