MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002172
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
//