ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002528
RECORD_TITLE: OLEYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: OLEYL ACETATE
CH$NAME: CIS-9-OCTADECENYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₀H₃₈O₂
CH$EXACT_MASS: 310.28718
CH$SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC
CH$IUPAC: InChI=1S/C20H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h11-12H,3-10,13-19H2,1-2H3/b12-11-
CH$LINK: INCHIKEY LVGKNOAMLMIIKO-QXMHVHEDSA-N
CH$LINK: COMPTOX DTXSID3047633

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-05o4-9100000000-a451572fc0202f2eb2cd
PK$NUM_PEAK: 81
PK$PEAK: m/z int. rel.int.
  15 3.83 38
  27 11.18 112
  28 2.78 28
  29 29 290
  31 1.34 13
  39 8.96 90
  40 2.19 22
  41 74.93 749
  42 14.29 143
  43 92.8 928
  44 2.98 30
  53 7.29 73
  54 45.15 452
  55 99.99 999
  56 25.41 254
  57 34.69 347
  58 1.57 16
  61 21.17 212
  65 1.67 17
  66 6.4 64
  67 64.93 649
  68 47.22 472
  69 62.18 622
  70 17.19 172
  71 11.62 116
  73 2.96 30
  77 2.02 20
  79 7.23 72
  80 7.14 71
  81 57.54 575
  82 91.28 913
  83 50.56 506
  84 10.52 105
  85 5.54 55
  91 1.96 20
  93 2.75 28
  94 3.64 36
  95 47.23 472
  96 71.72 717
  97 32.48 325
  98 6.12 61
  99 1.35 14
  105 1.07 11
  107 1.21 12
  108 2 20
  109 30.4 304
  110 33.04 330
  111 13.39 134
  112 3.44 34
  116 1.02 10
  121 1.27 13
  122 1.63 16
  123 15.29 153
  124 20.18 202
  125 6.25 63
  126 2.42 24
  137 9.15 92
  138 12.14 121
  139 2.87 29
  140 1.73 17
  151 3.9 39
  152 6.5 65
  153 1.67 17
  154 1.19 12
  165 2.25 23
  166 4.39 44
  167 1.5 15
  168 1.52 15
  179 1.6 16
  180 2.83 28
  193 1.59 16
  194 3.1 31
  196 1.54 15
  208 1.86 19
  222 5.75 58
  223 1.19 12
  224 2.21 22
  236 1.34 13
  250 19.07 191
  251 4.02 40
  310 0.5 5
//