ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007577
RECORD_TITLE: ALPHA-FARNESENE; 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$NAME: ALPHA-FARNESENE
CH$NAME: (3E,6E)-3,7,11-TRIMETHYL-1,3,6,10-DODECATETRAENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₄
CH$EXACT_MASS: 204.18780
CH$SMILES: C=CC(C)=C([H])CC([H])=C(C)CCC=C(C)C
CH$IUPAC: InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9-10,12H,1,7-8,11H2,2-5H3/b14-10-,15-12-
CH$LINK: INCHIKEY CXENHBSYCFFKJS-LOQWIJHWSA-N

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$SPLASH: splash10-05mo-9200000000-ac369415bd2e8b4e189c
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  27 13.92 139
  29 17.43 174
  41 92.89 929
  43 28.94 289
  53 17.33 173
  55 68.77 688
  67 13.32 133
  69 75.68 757
  79 44.75 448
  80 29.34 293
  91 25.43 254
  93 99.99 999
  105 19.33 193
  107 43.25 433
  119 39.45 395
  123 34.44 344
  133 6.12 61
  135 11.92 119
  147 2.61 26
  148 1.71 17
  161 5.92 59
  162 1.01 10
  189 2.11 21
  204 3.51 35
//