ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000249
RECORD_TITLE: MENTHOL; 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$NAME: MENTHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₂₀O
CH$EXACT_MASS: 156.15142
CH$SMILES: CC(C1)CC(O)C(C1)C(C)C
CH$IUPAC: InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3
CH$LINK: INCHIKEY NOOLISFMXDJSKH-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8029650

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$SPLASH: splash10-00ry-9000000000-1a50289cf86435b01727
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
  15 3.1 31
  27 41.1 411
  28 6 60
  29 3.69 37
  30 1.1 11
  31 9.8 98
  39 33.7 337
  40 0.55 6
  41 93.7 937
  42 11.4 114
  43 40.7 407
  44 0.69 7
  45 4.7 47
  51 3.6 36
  52 1.3 13
  53 1.75 18
  54 7.3 73
  55 57.1 571
  56 24.2 242
  57 2.95 30
  58 3.6 36
  59 2.4 24
  65 3.7 37
  66 0.16 2
  67 40.2 402
  68 14 140
  69 34.6 346
  70 1.29 13
  71 99.99 999
  72 5.5 55
  73 1.5 15
  77 0.41 4
  79 6.7 67
  80 13.1 131
  81 88.9 889
  82 4.11 41
  83 13.7 137
  84 3.7 37
  85 8.9 89
  86 0.36 4
  87 1 10
  91 1.9 19
  93 4.2 42
  94 0.65 7
  95 70.9 709
  96 28.1 281
  97 4.4 44
  99 0.37 4
  109 11.5 115
  110 8 80
  111 1.5 15
  112 0.15 2
  113 1.5 15
  123 29.7 297
  124 3.7 37
  138 3.51 35
  139 4.2 42
  141 1 10
//