ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002742
RECORD_TITLE: METHYL 2-TRIMETHYLSILOXY-HEXADECANOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, DEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: METHYL 2-TRIMETHYLSILOXY-HEXADECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₀H₄₂O₃Si
CH$EXACT_MASS: 358.29032
CH$SMILES: CCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C20H42O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20(21)22-2)23-24(3,4)5/h19H,6-18H2,1-5H3
CH$LINK: INCHIKEY ISYKTPYDGSSZAA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30335317

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$SPLASH: splash10-0005-9344000000-1385801019eaee3802c9
PK$NUM_PEAK: 102
PK$PEAK: m/z int. rel.int.
  39 1.5 15
  40 1.7 17
  41 12 120
  42 0.23 2
  43 18.3 183
  44 0.9 9
  45 4.4 44
  47 0.12 1
  53 1.3 13
  54 1.6 16
  55 11.4 114
  56 0.28 3
  57 13.3 133
  58 1.4 14
  59 9.8 98
  60 0.12 1
  61 2 20
  67 4.5 45
  68 2.2 22
  69 1.39 14
  70 2 20
  71 7.2 72
  72 2 20
  73 5.17 52
  74 6.2 62
  75 16.3 163
  76 1.6 16
  77 0.12 1
  79 1.3 13
  81 4.6 46
  82 2.7 27
  83 1.67 17
  84 1.8 18
  85 4.4 44
  86 0.9 9
  87 0.18 2
  88 0.9 9
  89 30 300
  90 2.7 27
  91 0.55 6
  93 0.9 9
  95 4.5 45
  96 1 10
  97 1.32 13
  98 1.9 19
  99 1.3 13
  101 3.5 35
  102 0.11 1
  103 17.4 174
  104 2 20
  105 1.7 17
  107 0.21 2
  108 1 10
  109 2.5 25
  110 0.9 9
  111 0.52 5
  112 1.2 12
  113 1 10
  115 2.9 29
  116 0.22 2
  117 1.6 16
  119 3.1 31
  123 1.3 13
  125 0.17 2
  129 10.3 103
  130 1.7 17
  131 2.3 23
  143 0.14 1
  145 1.9 19
  146 2.6 26
  147 0.5 5
  149 0.08 1
  159 8.5 85
  160 1.3 13
  161 1.5 15
  162 0.16 2
  171 0.9 9
  185 1.5 15
  191 0.1 1
  207 0.13 1
  225 0.9 9
  227 0.7 7
  257 0.8 8
  281 0.06 1
  282 0.2 2
  283 0.5 5
  297 1.3 13
  298 0.14 1
  299 99.99 999
  300 26.3 263
  301 7.2 72
  302 0.14 1
  315 4.3 43
  316 1.3 13
  341 0.7 7
  342 0.11 1
  343 36.3 363
  344 10 100
  345 3.1 31
  346 0.08 1
  355 0.3 3
  358 0.9 9
//