MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005222

MENTHOL; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005222
RECORD_TITLE: MENTHOL; CI-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

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CH$NAME: MENTHOL
CH$NAME: 5-METHYL-2-(1-METHYLETHYL)CYCLOHEXANOL
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

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AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

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PK$SPLASH: splash10-000i-3900000000-081c83125641df212ef8
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  80 2 20
  81 16.16 162
  83 18.57 186
  84 1.42 14
  95 5.5 55
  96 2.31 23
  97 1.85 19
  109 1 10
  111 0.81 8
  123 1.65 17
  125 1.01 10
  137 4.13 41
  138 9.2 92
  139 99.99 999
  140 13.5 135
  155 1.19 12
//