MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002053
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002053
RECORD_TITLE: 4-PHENYLPYRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: 4-PHENYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H9N
CH$EXACT_MASS: 155.07350
CH$SMILES: c(c2)ccc(c2)c(c1)ccnc1
CH$IUPAC: InChI=1S/C11H9N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-9H
CH$LINK: INCHIKEY
JVZRCNQLWOELDU-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5022140
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-4900000000-10e14e0d648ed0b56707
PK$NUM_PEAK: 64
PK$PEAK: m/z int. rel.int.
26 2.2 22
27 3.8 38
28 5.2 52
29 0.12 1
38 1.4 14
39 4.8 48
40 1 10
41 0.27 3
42 1.2 12
43 2.2 22
44 9.1 91
50 0.67 7
51 11.8 118
52 4 40
53 1.5 15
55 0.18 2
56 1.1 11
57 1.4 14
61 1.1 11
62 0.25 3
63 6.9 69
64 5 50
65 2.1 21
67 0.1 1
69 1 10
74 4.5 45
75 5.2 52
76 0.62 6
77 8.3 83
77.5 2.2 22
78 4.2 42
79 0.15 2
86 1.1 11
87 1.8 18
88 1.2 12
89 0.22 2
91 3.5 35
92 1.1 11
93 1.2 12
98 0.15 2
99 1.2 12
100 1.2 12
101 3.6 36
102 1.21 12
103 2.2 22
104 1.4 14
105 1.6 16
106 1.51 15
107 2 20
115 10.8 108
116 2.4 24
117 0.11 1
125 1 10
126 5.5 55
127 12.8 128
128 1.37 14
129 3.2 32
140 4.4 44
152 1.4 14
153 0.39 4
154 31 310
155 99.99 999
156 11.8 118
157 1.1 11
//