ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009068
RECORD_TITLE: ALLYL UNDECANOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: ALLYL UNDECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₆O₂
CH$EXACT_MASS: 226.19328
CH$SMILES: CCCCCCCCCCC(=O)OCC=C
CH$IUPAC: InChI=1S/C14H26O2/c1-3-5-6-7-8-9-10-11-12-14(15)16-13-4-2/h4H,2-3,5-13H2,1H3
CH$LINK: INCHIKEY PSGSIXPTLRADTD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID70169512

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-052f-9200000000-a2a5c3db02fe4caa426e
PK$NUM_PEAK: 60
PK$PEAK: m/z int. rel.int.
  15 1.27 13
  26 1.52 15
  27 14.95 150
  29 22.26 223
  30 1.01 10
  31 1.04 10
  39 20.63 206
  41 99.99 999
  42 13.12 131
  43 64.36 644
  44 1.28 13
  45 1.59 16
  53 2.77 28
  54 11.14 111
  55 46.37 464
  56 18.02 180
  57 50.07 501
  58 9.22 92
  59 1.79 18
  60 1.37 14
  67 6.28 63
  68 2.62 26
  69 24.77 248
  70 3.6 36
  71 21.98 220
  72 1.72 17
  73 3.1 31
  79 1.34 13
  81 7.45 75
  82 4.87 49
  83 21.1 211
  84 4.9 49
  85 17.16 172
  87 1.41 14
  93 1.37 14
  95 8.69 87
  96 1.49 15
  97 8.3 83
  98 4.15 42
  99 4.24 42
  100 46.51 465
  101 6.33 63
  107 1.27 13
  109 3.9 39
  111 3.65 37
  112 1.15 12
  113 23.65 237
  114 1.91 19
  115 1.19 12
  123 1.01 10
  125 3.1 31
  127 1.97 20
  141 1.11 11
  149 3.46 35
  155 1.6 16
  167 2.07 21
  169 32.45 325
  170 3.49 35
  183 2.62 26
  197 1.19 12
//