ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009338
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 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-022c-9600000000-eef9722199ac89858bae
PK$NUM_PEAK: 62
PK$PEAK: m/z int. rel.int.
  26 3.3 33
  27 39.1 391
  28 34.4 344
  29 1.96 20
  31 2.4 24
  38 3.9 39
  39 64.8 648
  40 1.23 12
  41 50.3 503
  42 3.8 38
  43 4 40
  50 0.71 7
  51 23.2 232
  52 14.1 141
  53 29.7 297
  55 0.5 5
  56 17.2 172
  62 2.3 23
  63 9.3 93
  64 0.34 3
  65 23.4 234
  66 10.3 103
  67 22.6 226
  68 0.58 6
  69 1.9 19
  77 41.2 412
  78 12.8 128
  79 7.08 71
  80 24.2 242
  81 11.8 118
  82 4.4 44
  89 0.22 2
  91 44.9 449
  92 8.6 86
  93 49.1 491
  94 2.4 24
  95 8.2 82
  96 2.2 22
  97 2.2 22
  103 0.31 3
  105 10.9 109
  106 3.9 39
  107 63.6 636
  108 3.34 33
  109 6.8 68
  115 2.7 27
  117 2.8 28
  119 0.24 2
  120 3 30
  121 61.6 616
  122 99.99 999
  123 1.35 14
  128 1.9 19
  131 5.5 55
  135 14 140
  136 9.77 98
  137 11.4 114
  146 2.8 28
  149 13.7 137
  150 0.24 2
  164 85.9 859
  165 12.4 124
//
