MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004638
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004638
RECORD_TITLE: (4-BROMO-(E)-1-BUTENYL)BENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KATO T, DEPT. OF CHEM., FAC. OF SCI., TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: (4-BROMO-(E)-1-BUTENYL)BENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H11Br
CH$EXACT_MASS: 210.00441
CH$SMILES: BrCCC([H])=C([H])c(c1)cccc1
CH$IUPAC: InChI=1S/C10H11Br/c11-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-8H,5,9H2/b8-4+
CH$LINK: CAS
7515-41-5
CH$LINK: INCHIKEY
YENIUOKSTSIUOR-XBXARRHUSA-N
AC$INSTRUMENT: HITACHI M-52
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-066u-7900000000-29e3445af18bc1463f5c
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
32 24.1 241
40 3.6 36
41 9.3 93
42 0.23 2
43 12.1 121
44 5.1 51
51 2 20
53 0.15 2
55 14.3 143
56 2.9 29
57 11.1 111
58 0.35 4
67 10.9 109
68 1.2 12
77 8.5 85
78 0.36 4
79 1.5 15
81 8.3 83
82 1.3 13
85 1.88 19
86 1.3 13
91 37.6 376
92 2.3 23
103 0.12 1
104 15.7 157
105 13.7 137
106 13.1 131
107 0.19 2
115 10.2 102
116 5.8 58
117 99.99 999
118 0.76 8
128 1.3 13
129 3.8 38
130 3.4 34
131 0.73 7
158 4.5 45
159 8.2 82
160 1.5 15
238 1.37 14
239 1.7 17
240 13.7 137
241 1.3 13
//