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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001570

CARVEOL(AXIAL); EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001570
RECORD_TITLE: CARVEOL(AXIAL); 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$NAME: CARVEOL(AXIAL)
CH$NAME: 2-METHYL-5-(1-METHYLETHENYL)-2-CYCLOHEXENE-1-OL(AXIAL)
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$SPLASH: splash10-001i-9300000000-c0df06475a23b1847e64
PK$NUM_PEAK: 73
PK$PEAK: m/z int. rel.int.
  27 18.02 180
  28 3.3 33
  29 13.04 130
  31 2.65 27
  38 1.37 14
  39 30.03 300
  40 6.13 61
  41 46.83 468
  42 3.97 40
  43 25.05 251
  44 2.99 30
  45 2.37 24
  50 1.95 20
  51 7.41 74
  52 3.49 35
  53 19.03 190
  54 5.62 56
  55 38.88 389
  56 21.3 213
  57 2.96 30
  58 1.31 13
  59 2.85 29
  61 1.76 18
  63 2.49 25
  65 9.23 92
  66 4.33 43
  67 22.9 229
  68 8.59 86
  69 26.65 267
  70 1.7 17
  71 3.52 35
  72 3.02 30
  77 17.02 170
  78 4 40
  79 24.49 245
  80 25.05 251
  81 25.95 260
  82 8.79 88
  83 37.51 375
  84 99.99 999
  85 6.18 62
  91 23.01 230
  92 14.83 148
  93 33.11 331
  94 20.29 203
  95 16.32 163
  96 7.19 72
  97 8.95 90
  103 1.62 16
  105 10.63 106
  106 5.59 56
  107 11.89 119
  108 9.93 99
  109 57.36 574
  110 7.27 73
  111 2.12 21
  115 1.43 14
  117 2.37 24
  119 26.31 263
  120 3.24 32
  121 3.49 35
  123 11.67 117
  124 2.65 27
  133 1.67 17
  134 67.24 672
  135 11.22 112
  136 1.81 18
  137 12.7 127
  138 1.53 15
  150 1.11 11
  151 2.79 28
  152 11.33 113
  153 1.53 15
//

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