ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000737
RECORD_TITLE: 2,5,5,11-TETRAMETHYL-8-ISOPROPYL-4,7,9-TRIOXA-1,11-DODECADIENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 2,5,5,11-TETRAMETHYL-8-ISOPROPYL-4,7,9-TRIOXA-1,11-DODECADIENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H30O3
CH$EXACT_MASS: 270.21949
CH$SMILES: CC(=C)COC(C(C)C)OCC(C)(C)OCC(C)=C
CH$IUPAC: InChI=1S/C16H30O3/c1-12(2)9-17-15(14(5)6)18-11-16(7,8)19-10-13(3)4/h14-15H,1,3,9-11H2,2,4-8H3
CH$LINK: INCHIKEY GELZIAQNOBTODO-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMS-4
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: splash10-0a4i-9200000000-85da374239b48eb1d6ed
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  39 11 110
  40 4 40
  41 14 140
  42 6 60
  43 10 100
  44 4 40
  45 3 30
  53 7 70
  54 5 50
  55 99.99 999
  56 13 130
  57 17 170
  58 4 40
  59 5 50
  67 4 40
  69 6 60
  70 12 120
  71 16 160
  72 10 100
  73 6 60
  81 7 70
  83 4 40
  85 5 50
  94 4 40
  95 4 40
  96 5 50
  97 3 30
  99 3.5 35
  101 12 120
  111 6 60
  113 4 40
  115 27 270
  116 5 50
  125 5 50
  126 6 60
  127 7 70
  142 3 30
  143 2 20
  155 3 30
  227 2 20
  270 0.1 1
//
