ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000133
RECORD_TITLE: CIS-BICYCLO(4.4.0)DECANE-2-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$NAME: CIS-BICYCLO(4.4.0)DECANE-2-ONE
CH$NAME: CIS-DECAHYDRO-2-NAPHTHALENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₆O
CH$EXACT_MASS: 152.12012
CH$SMILES: C1CC[C@H]2CC(=O)CC[C@H]2C1
CH$IUPAC: InChI=1S/C10H16O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-9H,1-7H2/t8-,9+/m1/s1
CH$LINK: INCHIKEY LGVJRKCQQHOWAU-BDAKNGLRSA-N
CH$LINK: COMPTOX DTXSID70883701

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$SPLASH: splash10-0pbc-9200000000-5e204815478f91be57a6
PK$NUM_PEAK: 67
PK$PEAK: m/z int. rel.int.
  26 2.8 28
  27 41.1 411
  28 12.7 127
  29 2.59 26
  31 1.5 15
  38 2.5 25
  39 56.3 563
  40 1.14 11
  41 83 830
  42 9.8 98
  43 8.3 83
  44 0.16 2
  50 2.9 29
  51 8.7 87
  52 5.4 54
  53 3.13 31
  54 39.3 393
  55 99.99 999
  56 8.7 87
  57 0.59 6
  58 1.3 13
  63 2.6 26
  65 9 90
  66 0.94 9
  67 77.7 777
  68 36.6 366
  69 17 170
  70 1.7 17
  71 10.3 103
  72 1 10
  77 10.2 102
  78 0.85 9
  79 38.4 384
  80 15.2 152
  81 92 920
  82 3.75 38
  83 16.1 161
  84 4 40
  85 1.1 11
  91 0.72 7
  92 5.4 54
  93 21.4 214
  94 51.8 518
  95 6.43 64
  96 38.4 384
  97 34.8 348
  98 5.1 51
  105 0.45 5
  106 3.7 37
  107 8.1 81
  108 93.8 938
  109 3.13 31
  110 21.4 214
  111 3 30
  119 5.7 57
  121 0.93 9
  122 1.4 14
  123 12.7 127
  124 5.4 54
  134 1.16 12
  135 2.7 27
  136 28.6 286
  137 7.9 79
  151 0.21 2
  152 78.6 786
  153 9.7 97
  154 1 10
//