ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008378
RECORD_TITLE: ALPHA-TERPINEOL; 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$NAME: ALPHA-TERPINEOL
CH$NAME: ALPHA,ALPHA,4-TRIMETHYL-3-CYCLOHEXENEMETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₈O
CH$EXACT_MASS: 154.13577
CH$SMILES: CC(C1)=C([H])CC([H])(C1)C(C)(C)O
CH$IUPAC: InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3/t9-/m1/s1
CH$LINK: INCHIKEY WUOACPNHFRMFPN-SECBINFHSA-N
CH$LINK: COMPTOX DTXSID5052672

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$SPLASH: splash10-052f-9200000000-c699dd9eba0f9966043c
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
  15 1.94 19
  27 11.03 110
  28 2.4 24
  29 7.46 75
  31 9.77 98
  39 15.09 151
  40 3.32 33
  41 23.57 236
  42 2.23 22
  43 43.94 439
  44 1.29 13
  45 2.07 21
  51 4.01 40
  52 1.94 19
  53 12.14 121
  54 5.19 52
  55 15.19 152
  57 1.55 16
  58 1.63 16
  59 99.99 999
  60 3.15 32
  63 1.14 11
  65 4.54 45
  66 1.82 18
  67 18.31 183
  68 13.97 140
  69 4.65 47
  71 10.31 103
  77 10.99 110
  78 2.08 21
  79 16.05 161
  80 6.09 61
  81 35.44 354
  82 2.15 22
  91 7.77 78
  92 16.03 160
  93 55.89 559
  94 7.94 79
  95 14.88 149
  96 6.41 64
  105 2.45 25
  107 6.87 69
  108 3.06 31
  121 52.81 528
  122 5.28 53
  136 43.87 439
  137 5.57 56
  139 7.2 72
//