MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002175
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002175
RECORD_TITLE: TETRAPHENYLTIN; 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$NAME: TETRAPHENYLTIN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C24H20Sn
CH$EXACT_MASS: 428.05870
CH$SMILES: c([Sn](c(c4)cccc4)(c(c3)cccc3)c(c2)cccc2)(c1)cccc1
CH$IUPAC: InChI=1S/4C6H5.Sn/c4*1-2-4-6-5-3-1;/h4*1-5H;
CH$LINK: INCHIKEY
CRHIAMBJMSSNNM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9022071
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$SPLASH: splash10-0f6t-1925000000-50dff29b233b751a3a0a
PK$NUM_PEAK: 73
PK$PEAK: m/z int. rel.int.
45 4.31 43
50 10.07 101
51 38.84 388
52 3.95 40
55 7.19 72
56 2.51 25
57 9.35 94
60 3.95 40
70 1.07 11
71 3.23 32
73 2.87 29
74 1.43 14
75 1.43 14
77 14.38 144
78 4.67 47
83 1.79 18
85 2.15 22
112 3.59 36
113 1.07 11
114 1.79 18
115 3.59 36
116 45.68 457
117 26.61 266
118 75.89 759
119 26.97 270
120 99.99 999
121 2.15 22
122 14.74 147
124 16.9 169
141 1.43 14
143 2.51 25
145 3.23 32
151 1.43 14
152 8.63 86
153 6.11 61
154 8.99 90
155 1.79 18
169 1.07 11
189 1.79 18
191 1.79 18
192 2.51 25
193 34.17 342
194 21.94 219
195 56.83 568
196 25.89 259
197 74.46 745
198 4.67 47
199 10.07 101
200 1.07 11
201 12.23 122
268 1.43 14
269 2.51 25
270 17.98 180
271 14.02 140
272 30.57 306
273 17.98 180
274 37.05 371
275 4.67 47
276 5.39 54
278 5.75 58
343 2.51 25
345 1.79 18
346 2.15 22
347 38.12 381
348 31.29 313
349 73.74 737
350 42.08 421
351 92.8 928
352 18.7 187
353 14.38 144
354 2.87 29
355 15.82 158
356 2.51 25
//