MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002169
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002169
RECORD_TITLE: TRI-BUTHYLTIN FLUORIDE; 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$NAME: TRI-BUTHYLTIN FLUORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H27FSn
CH$EXACT_MASS: 310.11188
CH$SMILES: CCCC[Sn](F)(CCCC)CCCC
CH$IUPAC: InChI=1S/3C4H9.FH.Sn/c3*1-3-4-2;;/h3*1,3-4H2,2H3;1H;/q;;;;+1/p-1
CH$LINK: CAS
1983-10-4
CH$LINK: INCHIKEY
DFNPRTKVCGZMMC-UHFFFAOYSA-M
CH$LINK: COMPTOX
DTXSID1032480
AC$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: splash10-0udi-1970000000-d2ae49205af4a824b734
PK$NUM_PEAK: 98
PK$PEAK: m/z int. rel.int.
51 1.22 12
53 2.28 23
55 8.3 83
56 3.45 35
57 60.21 602
58 2.96 30
69 2.07 21
116 2.62 26
117 11.06 111
118 8.95 90
119 17.96 180
120 10.8 108
121 21.03 210
123 3.37 34
125 3.79 38
131 2.75 28
132 1.16 12
133 3.19 32
134 1.94 19
135 18.07 181
136 8.82 88
137 25.49 255
138 9.65 97
139 33.26 333
141 5.08 51
143 6.31 63
145 2.33 23
146 1.11 11
147 3.32 33
149 3.68 37
151 2.33 23
152 1.22 12
153 4.02 40
154 2.02 20
155 4.9 49
157 1.86 19
159 1.06 11
163 1.86 19
164 1.81 18
165 3.5 35
166 2.36 24
167 4.62 46
168 1.92 19
169 2.72 27
171 2.49 25
172 2.02 20
173 29.31 293
174 17.86 179
175 49.44 494
176 21.29 213
177 64.37 644
178 4.05 41
179 10.56 106
181 11.01 110
191 2.05 21
192 2.38 24
193 9.68 97
194 6.67 67
195 14.64 146
196 6.82 68
197 13.99 140
198 1.03 10
199 2.59 26
201 2.44 24
209 2.18 22
210 1.42 14
211 4.02 40
212 1.76 18
213 4.72 47
215 1.73 17
231 2.15 22
232 1.55 16
233 2.93 29
234 1.42 14
235 1.58 16
245 3.11 31
247 2.31 23
248 2.7 27
249 45.33 453
250 31.78 318
251 77.27 773
252 38.32 383
253 99.99 999
254 9.58 96
255 14.15 142
256 2.28 23
257 15.96 160
258 1.53 15
265 3.97 40
266 2.72 27
267 7.58 76
268 4.2 42
269 10.28 103
270 1.84 18
271 3.84 38
273 1.68 17
289 1.06 11
291 1.27 13
//