ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010162
RECORD_TITLE: 3,7,11-TRIMETHYL-6,10-DODECADIENE-1-CARBOXYLIC ACID ETHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 3,7,11-TRIMETHYL-6,10-DODECADIENE-1-CARBOXYLIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₃₀O₂
CH$EXACT_MASS: 266.22458
CH$SMILES: CCOC(=O)CC(C)CCC=C(C)CCC=C(C)C
CH$IUPAC: InChI=1S/C17H30O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h9,11,16H,6-8,10,12-13H2,1-5H3/b15-11+
CH$LINK: INCHIKEY AVNMXCJYOADGLH-RVDMUPIBSA-N

AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-014i-9610000000-8ed9c7b3b13458fe2aae
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  29 8 80
  41 34 340
  53 8 80
  67 1.1 11
  68 6 60
  69 99.99 999
  70 8 80
  71 0.4 4
  79 6 60
  81 15 150
  82 11 110
  87 0.9 9
  88 3 30
  93 8 80
  94 10 100
  95 1.5 15
  96 5 50
  107 6 60
  108 8 80
  109 9.7 97
  110 19 190
  111 2 20
  113 5 50
  115 0.2 2
  121 6 60
  122 9 90
  123 24 240
  124 0.6 6
  129 6 60
  135 7 70
  137 5 50
  141 0.4 4
  151 9 90
  152 9 90
  153 8 80
  163 0.5 5
  177 12 120
  178 5 50
  223 25 250
  224 0.6 6
  266 8 80
//