ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009867
RECORD_TITLE: 5,5-DICHLORO-3-METHYL-2,4-PENTADIENYL ACETATE; 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$NAME: 5,5-DICHLORO-3-METHYL-2,4-PENTADIENYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀Cl₂O₂
CH$EXACT_MASS: 208.00578
CH$SMILES: CC(=O)OCC=C(C)C=C(Cl)Cl
CH$IUPAC: InChI=1S/C8H10Cl2O2/c1-6(5-8(9)10)3-4-12-7(2)11/h3,5H,4H2,1-2H3/b6-3+
CH$LINK: INCHIKEY LSFBFKFSLCFMGT-ZZXKWVIFSA-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$SPLASH: splash10-0006-9100000000-a7a6d8b2e5b1e08d1b0e
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  27 1.5 15
  28 5.3 53
  39 3.2 32
  41 1.3 13
  43 99.99 999
  44 2.5 25
  45 3 30
  50 1 10
  51 3 30
  65 2.8 28
  73 3 30
  77 15 150
  78 1.8 18
  79 1 10
  95 2.2 22
  113 10.3 103
  114 1 10
  115 3.2 32
  131 1.2 12
  148 2 20
  149 0.8 8
  150 1.2 12
  173 1.2 12
  208 1 10
  210 0.7 7
//