ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001571
RECORD_TITLE: CARVEOL(EQUATRIAL); 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$NAME: CARVEOL(EQUATRIAL)
CH$NAME: 2-METHYL-5-(1-METHYLETHENYL)-2-CYCLOHEXENE-1-OL(EQUATRIAL)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₆O
CH$EXACT_MASS: 152.12012
CH$SMILES: CC(=C)C(C1)CC(O)C(C)=C1
CH$IUPAC: InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3
CH$LINK: INCHIKEY BAVONGHXFVOKBV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3024736

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$SPLASH: splash10-0a5c-9400000000-20e9d5aa724b146ecbe0
PK$NUM_PEAK: 66
PK$PEAK: m/z int. rel.int.
  27 16.97 170
  28 4.73 47
  29 10.46 105
  31 2.66 27
  38 1.48 15
  39 26.55 266
  40 5.62 56
  41 38.79 388
  42 2.66 27
  43 24.38 244
  44 3.15 32
  45 2.27 23
  50 2.36 24
  51 6.61 66
  52 3.15 32
  53 15.2 152
  54 6.31 63
  55 33.07 331
  56 19.24 192
  57 2.66 27
  63 2.76 28
  65 8.48 85
  66 3.35 34
  67 17.76 178
  68 7.2 72
  69 20.53 205
  70 1.77 18
  71 3.35 34
  72 1.87 19
  77 13.52 135
  78 4.48 45
  79 12.24 122
  80 13.32 133
  81 16.09 161
  82 12.53 125
  83 35.24 352
  84 70.68 707
  85 5.23 52
  91 21.91 219
  92 7.6 76
  93 18.75 188
  94 6.12 61
  95 14.61 146
  96 11.45 115
  97 8.39 84
  103 1.97 20
  105 8.68 87
  106 3.45 35
  107 6.51 65
  108 14.21 142
  109 99.99 999
  110 12.33 123
  111 2.66 27
  115 1.77 18
  117 2.46 25
  119 17.76 178
  120 2.46 25
  121 1.67 17
  123 10.06 101
  124 4.14 41
  134 6.81 68
  135 2.66 27
  137 15.3 153
  138 1.67 17
  152 34.25 343
  153 4.14 41
//