ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002172
RECORD_TITLE: TRIBUTYLTIN ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: TRIBUTYLTIN ACETATE
CH$NAME: TRIBUTYLSTANNYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₃₀O₂Sn
CH$EXACT_MASS: 350.12678
CH$SMILES: CCCC[Sn](CCCC)(CCCC)OC(C)=O
CH$IUPAC: InChI=1S/3C4H9.C2H4O2.Sn/c3*1-3-4-2;1-2(3)4;/h3*1,3-4H2,2H3;1H3,(H,3,4);/q;;;;+1/p-1
CH$LINK: INCHIKEY PWBHRVGYSMBMIO-UHFFFAOYSA-M
CH$LINK: COMPTOX DTXSID7043954

AC$INSTRUMENT: VARIAN MAT-44
AC$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$SPLASH: splash10-002f-1890000000-e100f32d003c01572593
PK$NUM_PEAK: 80
PK$PEAK: m/z int. rel.int.
  53 1.33 13
  55 4.46 45
  56 2.15 22
  57 32.81 328
  58 1.56 16
  60 2.8 28
  69 24.07 241
  76 3.25 33
  100 1.2 12
  116 2.21 22
  117 8.73 87
  118 7.82 78
  119 20.56 206
  120 9.97 100
  121 18.86 189
  122 1.17 12
  123 3.97 40
  125 3.25 33
  126 1.72 17
  131 5.83 58
  132 1.49 15
  133 9.44 94
  134 5.79 58
  135 15.44 154
  136 5.44 54
  137 18.44 184
  138 1.36 14
  139 4.07 41
  141 3.19 32
  145 1.43 14
  147 2.08 21
  149 2.37 24
  153 1.07 11
  155 1.3 13
  169 4.33 43
  171 2.6 26
  173 13.39 134
  174 9.18 92
  175 48.12 481
  176 25.83 258
  177 74.09 741
  178 22.9 229
  179 69.4 694
  180 4 40
  181 19.74 197
  182 1.04 10
  183 11.4 114
  213 1.07 11
  229 6.25 63
  230 4.43 44
  231 12.74 127
  232 6.77 68
  233 18.21 182
  234 4.13 41
  235 6.41 64
  236 1.92 19
  237 4.72 47
  249 1.14 11
  251 1.98 20
  253 2.47 25
  265 1.04 10
  267 1.95 20
  268 1.01 10
  269 2.96 30
  271 1.14 11
  285 3.16 32
  287 3.71 37
  288 5.27 53
  289 51.31 513
  290 39.36 394
  291 84.09 841
  292 47.73 477
  293 99.99 999
  294 13.62 136
  295 15.34 153
  296 4.04 40
  297 15.21 152
  298 1.79 18
  376 1.23 12
  471 1.07 11
//