ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001866
RECORD_TITLE: METHYL 2-TRIMETHYLSILOXYOCTADECANOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SEYAMA Y, DEPT. OF PHYSIOL. CHEMISTRY AND NUTRITION, FAC. OF MEDICINE, UNIV. OF TOKYO
LICENSE: CC BY-NC-SA

CH$NAME: METHYL 2-TRIMETHYLSILOXYOCTADECANOATE
CH$NAME: METHYL (O-TRIMETHYLSILYL)-ALPHA-HYDROXYSTEARATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₂H₄₆O₃Si
CH$EXACT_MASS: 386.32162
CH$SMILES: CCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C22H46O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22(23)24-2)25-26(3,4)5/h21H,6-20H2,1-5H3
CH$LINK: INCHIKEY MPVPFICBAYSSLQ-UHFFFAOYSA-N

AC$INSTRUMENT: SHIMADZU LKB-9000B
AC$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$SPLASH: splash10-00b9-9205000000-75d1c3ec3f329a2f48a8
PK$NUM_PEAK: 67
PK$PEAK: m/z int. rel.int.
  41 11.8 118
  42 2.3 23
  43 20.2 202
  45 3.3 33
  52 1.2 12
  54 1.2 12
  55 11.7 117
  56 2.7 27
  57 15.5 155
  58 1.2 12
  59 7.4 74
  61 1.4 14
  67 4.4 44
  68 1.8 18
  69 12.3 123
  70 2.2 22
  71 8 80
  72 1.4 14
  73 66.3 663
  74 6.5 65
  75 17.1 171
  76 1.3 13
  77 1.3 13
  79 1.4 14
  80 1.1 11
  81 5.7 57
  82 2.9 29
  83 14.5 145
  84 1.7 17
  85 4.2 42
  87 2.5 25
  89 30.8 308
  90 2.6 26
  91 6.1 61
  95 5.7 57
  97 13.7 137
  98 1.3 13
  99 1.2 12
  101 3.1 31
  103 18.3 183
  104 1.7 17
  105 2.4 24
  107 1.7 17
  109 3 30
  111 6.8 68
  115 2.6 26
  116 1.8 18
  117 2.1 21
  119 2.2 22
  123 1 10
  125 1.8 18
  129 13.6 136
  130 1.7 17
  131 2.6 26
  143 1.7 17
  145 1.9 19
  146 2.1 21
  159 9.3 93
  162 1.3 13
  327 99.99 999
  328 26.5 265
  329 6.6 66
  343 3.5 35
  371 32.4 324
  372 9 90
  373 1.8 18
  386 0.7 7
//