MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004562
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004562
RECORD_TITLE: 1,1-BIS(PARA-CHLOROPHENYL)-2-CHLOROETHENE; 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$NAME: 1,1-BIS(PARA-CHLOROPHENYL)-2-CHLOROETHENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H9Cl3
CH$EXACT_MASS: 281.97698
CH$SMILES: ClC=C(c(c2)ccc(Cl)c2)c(c1)ccc(Cl)c1
CH$IUPAC: InChI=1S/C14H9Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H
CH$LINK: INCHIKEY
LNKQQZFLNUVWQQ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6073940
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$SPLASH: splash10-001i-1290000000-8045a277a479aa6efa73
PK$NUM_PEAK: 123
PK$PEAK: m/z int. rel.int.
36 1.1 11
38 0.6 6
39 1.8 18
40 0.81 8
41 0.8 8
43 0.8 8
44 1.7 17
45 0.06 1
50 3.9 39
51 4.1 41
55 0.7 7
57 0.09 1
61 0.8 8
62 1.8 18
63 2.6 26
67 0.06 1
69 0.8 8
70 0.5 5
73 2.4 24
74 0.53 5
75 12.4 124
76 2.2 22
77 1 10
81 0.08 1
82 0.6 6
83 0.6 6
85 1.4 14
86 0.18 2
87 5.6 56
88 18.7 187
89 2.9 29
92 0.1 1
93 3.4 34
94 1.4 14
96 0.7 7
97 0.1 1
98 2.2 22
99 3.8 38
100 1.3 13
101 0.36 4
102 0.6 6
105 12.2 122
106 8.3 83
107 0.22 2
109 0.7 7
110 3.1 31
111 3.4 34
112 0.08 1
113 1.4 14
122 0.9 9
123 12.4 124
124 0.77 8
125 2.6 26
126 2 20
127 0.6 6
133 0.06 1
135 1.4 14
136 5.9 59
137 1.8 18
138 0.26 3
139 0.8 8
141 0.7 7
142 0.6 6
146 0.05 1
147 0.9 9
148 0.8 8
149 2.4 24
150 0.46 5
151 5.2 52
152 1.1 11
160 1.1 11
161 0.06 1
162 0.7 7
163 1.5 15
170 0.7 7
172 0.07 1
173 1.3 13
174 3.9 39
175 7.3 73
176 3.6 36
177 11.1 111
178 1.9 19
180 0.8 8
181 0.07 1
182 1 10
183 0.7 7
184 0.9 9
185 0.08 1
186 1.7 17
199 0.5 5
207 0.6 6
208 0.07 1
209 1.1 11
210 3.9 39
211 9.7 97
212 9.67 97
213 18.5 185
214 33.4 334
215 5.5 55
216 0.13 1
217 1 10
218 0.8 8
219 0.6 6
233 0.42 4
234 0.6 6
235 2.8 28
237 0.5 5
245 0.08 1
246 10.7 107
247 26.9 269
248 10.7 107
249 1.72 17
250 3.4 34
251 2.8 28
280 0.9 9
281 0.21 2
282 99.99 999
283 16.6 166
284 91.9 919
285 1.52 15
286 29.9 299
287 4.7 47
288 3.1 31
//