ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008622
RECORD_TITLE: 2-ACETYL-3,3-DIMETHYLNORBORNANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 2-ACETYL-3,3-DIMETHYLNORBORNANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H18O
CH$EXACT_MASS: 166.13577
CH$SMILES: CC(=O)C(C21)C(C)(C)C(CC2)C1
CH$IUPAC: InChI=1S/C11H18O/c1-7(12)10-8-4-5-9(6-8)11(10,2)3/h8-10H,4-6H2,1-3H3
CH$LINK: INCHIKEY NGTMQRCBACIUES-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5052094
AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-052f-9300000000-c788ea2dc609ab8d5ed5
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
  15 3.71 37
  27 13.44 134
  29 7.74 77
  39 23.66 237
  41 41.44 414
  42 2.98 30
  43 99.99 999
  44 1.54 15
  45 2.3 23
  50 1.09 11
  51 3.77 38
  52 2.16 22
  53 14.44 144
  54 2.91 29
  55 21.53 215
  56 1.61 16
  57 3.39 34
  63 1.19 12
  65 5.35 54
  66 5.06 51
  67 49.62 496
  68 3.77 38
  69 15.61 156
  70 1.3 13
  71 2.36 24
  77 10.79 108
  78 2.13 21
  79 16.63 166
  80 4.15 42
  81 47.11 471
  82 5.41 54
  83 12.88 129
  84 6.91 69
  85 5.58 56
  91 5.74 57
  92 1.11 11
  93 21.32 213
  94 2.3 23
  95 11.61 116
  96 2.93 29
  97 3.86 39
  98 1.4 14
  99 68.39 684
  100 4.43 44
  105 2.77 28
  106 1.96 20
  107 8.47 85
  108 64.49 645
  109 16.62 166
  110 2.28 23
  121 1.16 12
  123 75.4 754
  124 5.97 60
  133 2.46 25
  148 11.28 113
  149 1.37 14
  151 5.7 57
  166 3.71 37
//
