ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011877
RECORD_TITLE: BICYCLO(4,3,0)NONAN-8-ONE; 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$NAME: BICYCLO(4,3,0)NONAN-8-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₄O
CH$EXACT_MASS: 138.10447
CH$SMILES: O=C(C1)CC(C2)C(CCC2)1
CH$IUPAC: InChI=1S/C9H14O/c10-9-5-7-3-1-2-4-8(7)6-9/h7-8H,1-6H2
CH$LINK: INCHIKEY HAMUKWWZXAKCAU-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$SPLASH: splash10-00ko-9100000000-dcf8e726c29c802ce6e3
PK$NUM_PEAK: 70
PK$PEAK: m/z int. rel.int.
  15 2.7 27
  26 3.1 31
  27 32.9 329
  28 8.3 83
  29 16.8 168
  31 1.1 11
  32 1.8 18
  37 1.1 11
  38 2.8 28
  39 44.2 442
  40 10.2 102
  41 65.2 652
  42 5.8 58
  43 4.6 46
  44 1.2 12
  45 1 10
  46 1 10
  50 3.7 37
  51 8.3 83
  52 4.3 43
  53 21.4 214
  54 49.4 494
  55 27.6 276
  56 7.4 74
  57 11.2 112
  58 1.5 15
  62 1.6 16
  63 3.4 34
  64 1.9 19
  65 6.1 61
  66 6.5 65
  67 63.1 631
  68 35.5 355
  69 10.7 107
  70 6.4 64
  71 2.5 25
  77 8.2 82
  78 3.7 37
  79 15.5 155
  80 9.3 93
  81 68.1 681
  82 27.6 276
  83 5.7 57
  84 4 40
  89 1.5 15
  91 8.3 83
  92 5.1 51
  93 5.5 55
  94 99.99 999
  95 33.2 332
  96 25.7 257
  97 3.6 36
  103 2.2 22
  104 1.7 17
  105 22.5 225
  106 4.1 41
  107 2.1 21
  109 9.3 93
  110 5 50
  115 2.8 28
  116 2.5 25
  119 1.1 11
  120 3.7 37
  122 7.3 73
  123 3.5 35
  134 10.1 101
  135 1.5 15
  137 1.9 19
  138 53.2 532
  139 5.4 54
//