ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001870
RECORD_TITLE: METHYL 2-TRIMETHYLSILOXYDOCOSANOATE; 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$NAME: METHYL 2-TRIMETHYLSILOXYDOCOSANOATE
CH$NAME: METHYL (O-TRIMETHYLSILYL)-ALPHA-HYDROXYBEHENATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₆H₅₄O₃Si
CH$EXACT_MASS: 442.38422
CH$SMILES: CCCCCCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C26H54O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26(27)28-2)29-30(3,4)5/h25H,6-24H2,1-5H3
CH$LINK: INCHIKEY QSSVMTKWPPSPAQ-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$SPLASH: splash10-001i-9204100000-4a89313bf56153f70ec6
PK$NUM_PEAK: 68
PK$PEAK: m/z int. rel.int.
  41 10 100
  42 2.3 23
  43 21.8 218
  44 1 10
  45 1.8 18
  54 1.5 15
  55 12.4 124
  56 2.6 26
  57 19.7 197
  58 1.1 11
  59 6.6 66
  61 1.7 17
  67 4.3 43
  68 2.7 27
  69 11.3 113
  70 2 20
  71 10.8 108
  72 1.2 12
  73 61.3 613
  74 6.2 62
  75 15.2 152
  76 1.4 14
  81 5.1 51
  82 3 30
  83 13.8 138
  84 1.4 14
  85 5.5 55
  87 1.6 16
  89 26.4 264
  90 2.1 21
  91 6.2 62
  95 5.8 58
  97 12.7 127
  98 1.5 15
  99 1.4 14
  101 2.8 28
  103 16.3 163
  104 2 20
  105 1.8 18
  107 1.4 14
  109 3.5 35
  111 5.9 59
  115 2.8 28
  116 2 20
  117 1.8 18
  119 1.8 18
  123 1.4 14
  125 2.2 22
  129 16.7 167
  130 2.1 21
  131 2.1 21
  143 2.3 23
  145 2.3 23
  146 2.2 22
  159 9.7 97
  160 1 10
  161 1 10
  162 1.6 16
  185 1.1 11
  383 99.99 999
  384 32 320
  385 8.4 84
  386 1 10
  399 3.5 35
  427 32.7 327
  428 11 110
  429 2.7 27
  442 2.3 23
//