MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010472
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010472
RECORD_TITLE: 1,2-DIPHENYLBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: 1,2-DIPHENYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H14
CH$EXACT_MASS: 230.10955
CH$SMILES: c(c3)ccc(c3)c(c2)c(ccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C18H14/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16/h1-14H
CH$LINK: INCHIKEY
OIAQMFOKAXHPNH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1049697
AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-003r-1190000000-f4753780c81afbdc349d
PK$NUM_PEAK: 54
PK$PEAK: m/z int. rel.int.
39 9.01 90
51 1.97 20
62 2.32 23
63 8.66 87
75 3.11 31
76 2.75 28
77 3.16 32
86 2.35 24
87 4.18 42
88 3.54 35
89 2.93 29
95 2.41 24
98 1.65 17
99 1.96 20
100 3.8 38
101 9.44 94
102 2.83 28
108 3.03 30
112 1.08 11
113 4.8 48
114 5.12 51
115 3.36 34
150 1.34 13
151 2.09 21
152 3.11 31
163 2.38 24
164 1.1 11
165 5.51 55
174 1.07 11
175 1.19 12
176 3.42 34
177 1.03 10
178 2.27 23
187 2.03 20
188 1.27 13
189 4.22 42
200 4.86 49
201 4.22 42
202 15.28 153
203 5.68 57
204 1.22 12
213 2.59 26
214 1.01 10
215 26.94 269
216 5.05 51
224 1.96 20
225 2.47 25
226 14.26 143
227 10.59 106
228 28.35 284
229 51.95 520
230 99.99 999
231 18.97 190
232 1.8 18
//