ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005221
RECORD_TITLE: CARVOMENTHOL; 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

CH$NAME: CARVOMENTHOL
CH$NAME: (1ALPHA,2BETA,5ALPHA)-2-METHYL-5-(1-METHYLETHYL)CYCLOHEXANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₂₀O
CH$EXACT_MASS: 156.15142
CH$SMILES: CC(C)C(C1)CC(O)C(C)C1
CH$IUPAC: InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)10(11)6-9/h7-11H,4-6H2,1-3H3
CH$LINK: INCHIKEY ULJXKUJMXIVDOY-UHFFFAOYSA-N

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

PK$SPLASH: splash10-000i-0900000000-fd8222a44c8e1c2c52b9
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  81 0.98 10
  84 3.8 38
  95 1.4 14
  125 1.13 11
  137 2.83 28
  138 6.14 61
  139 99.99 999
  140 11.97 120
  155 3.57 36
  156 1.04 10
//