ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005329
RECORD_TITLE: ALPHA-TERPINEOL; 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$NAME: ALPHA-TERPINEOL
CH$NAME: P-MENTH-1-EN-8-OL
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$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-052f-9200000000-b00b2a6ddf8692ac7554
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
  15 1.7 17
  27 8.06 81
  28 1.07 11
  29 5.99 60
  31 8.06 81
  39 10.29 103
  40 2.42 24
  41 17.37 174
  42 1.43 14
  43 34.13 341
  45 1.97 20
  51 2.59 26
  52 1.34 13
  53 7.97 80
  54 4.92 49
  55 12.63 126
  57 1.07 11
  58 1.07 11
  59 99.99 999
  60 3.31 33
  65 2.95 30
  66 1.43 14
  67 14.86 149
  68 14.96 150
  69 3.58 36
  71 7.79 78
  77 7.07 71
  78 1.61 16
  79 10.74 107
  80 5.55 56
  81 31.13 311
  82 2.33 23
  91 5.46 55
  92 15.22 152
  93 51.34 513
  94 7.43 74
  95 13.97 140
  96 7.25 73
  105 2.23 22
  107 5.01 50
  108 2.33 23
  121 38.27 383
  122 4.02 40
  136 41.81 418
  137 5.28 53
  139 6.89 69
  154 0.35 4
//