ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007570
RECORD_TITLE: 1-TERPINEOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKEUCHI T, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 1-TERPINEOL
CH$NAME: 1-METHYL-4-(1-METHYLETHYL)-3-CYCLOHEXEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₈O
CH$EXACT_MASS: 154.13577
CH$SMILES: CC(C)C(C1)=C([H])CC(C)(O)C1
CH$IUPAC: InChI=1S/C10H18O/c1-8(2)9-4-6-10(3,11)7-5-9/h4,8,11H,5-7H2,1-3H3
CH$LINK: CAS 586-82-3
CH$LINK: INCHIKEY XJWZDXFFNOMMTD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40862245

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

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-053r-9400000000-594c99fea4e283e4cb10
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  58 67.49 675
  69 47.53 475
  71 22.58 226
  80 40.28 403
  81 99.99 999
  93 53.69 537
  96 52.3 523
  107 40.66 407
  111 33.27 333
  121 50.54 505
  125 16.58 166
  136 45.26 453
  139 14.56 146
  154 7.01 70
//