ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007592
RECORD_TITLE: FENCHYL ALCOHOL (2-D1); EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKEUCHI T, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: FENCHYL ALCOHOL (2-D1)
CH$NAME: 1,3,3-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-OL (2-D1)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₈O
CH$EXACT_MASS: 154.13577
CH$SMILES: [2H]OC(C(C)(C)1)C(C)(C2)CC(C2)1
CH$IUPAC: InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3/i11D
CH$LINK: INCHIKEY IAIHUHQCLTYTSF-WORMITQPSA-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 15 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001i-9100000000-97c1aaad48d62ad0ab30
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  43 5.77 58
  55 1.99 20
  56 1.47 15
  57 1.08 11
  58 1.13 11
  59 1.04 10
  67 2.82 28
  69 7.15 72
  70 2.04 20
  71 1.78 18
  72 13.48 135
  73 14.66 147
  74 2.08 21
  80 99.99 999
  81 83.99 840
  82 18.82 188
  83 9.76 98
  84 14.87 149
  85 6.81 68
  86 2.3 23
  93 4.73 47
  94 10.06 101
  95 3.9 39
  96 4.12 41
  97 3.21 32
  98 2.51 25
  99 2.51 25
  100 1.34 13
  107 8.41 84
  108 2.47 25
  109 1.86 19
  110 1.65 17
  111 2.12 21
  112 13.61 136
  113 1.86 19
  122 8.67 87
  123 6.16 62
  124 1 10
  125 2.69 27
  137 6.16 62
  140 4.47 45
  155 6.24 62
//