MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001588
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001588
RECORD_TITLE: DIPHENYL; 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$NAME: DIPHENYL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10
CH$EXACT_MASS: 154.07825
CH$SMILES: c(c2)ccc(c2)c(c1)cccc1
CH$IUPAC: InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H
CH$LINK: CAS
92-52-4
CH$LINK: INCHIKEY
ZUOUZKKEUPVFJK-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4020161
AC$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-8900000000-e5b4f289ac40ae7f058d
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
40 1.28 13
41 5.94 59
42 1.84 18
43 10.41 104
44 2.82 28
45 2.82 28
50 8.82 88
51 16.76 168
52 3.48 35
55 5.48 55
56 2.46 25
57 5.89 59
58 1.17 12
60 4 40
61 1.84 18
62 4 40
63 14.35 144
64 11.53 115
65 2.66 27
67 1.28 13
68 1.02 10
69 4.56 46
70 1.84 18
71 2.82 28
73 4.51 45
74 5.69 57
75 9.89 99
76 40.35 404
77 15.74 157
78 2.35 24
81 1.33 13
83 2.05 21
84 1.17 12
85 1.74 17
86 1.53 15
87 2.71 27
88 1.12 11
89 2.97 30
97 1.58 16
98 1.94 19
99 1.33 13
101 2 20
102 4.35 44
113 1.23 12
115 5.79 58
125 1.02 10
126 3.69 37
127 3.74 37
128 4.82 48
129 1.43 14
139 1.84 18
149 1.74 17
150 3.38 34
151 10.41 104
152 30.56 306
153 47.58 476
154 99.99 999
155 13.23 132
//