MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010676
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010676
RECORD_TITLE: BETA-FARNESENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: EGUCHI S, FAC. OF SCIENCE, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: BETA-FARNESENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H24
CH$EXACT_MASS: 204.18780
CH$SMILES: C=CC(=C)CCC([H])=C(C)CCC=C(C)C
CH$IUPAC: InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,1,4,7-8,10-11H2,2-3,5H3/b15-12+
CH$LINK: INCHIKEY
JSNRRGGBADWTMC-NTCAYCPXSA-N
CH$LINK: COMPTOX
DTXSID9047049
AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-00kf-9300000000-b9d4d3c4eb1b8ad6bb3d
PK$NUM_PEAK: 55
PK$PEAK: m/z int. rel.int.
41 99.99 999
42 13 130
43 28.5 285
51 1.1 11
52 9 90
53 28 280
54 8 80
55 4.1 41
56 9 90
57 16 160
65 6.5 65
66 0.8 8
67 29 290
68 16.5 165
69 98 980
70 1.4 14
71 11 110
77 20.5 205
78 8.5 85
79 3.4 34
80 16.5 165
81 37 370
82 16 160
83 0.9 9
91 26.5 265
92 16 160
93 67 670
94 1.6 16
95 16 160
96 7 70
105 23 230
106 1.1 11
107 21 210
108 10 100
109 16.5 165
110 0.6 6
119 18 180
120 20.5 205
121 17 170
122 0.8 8
123 8 80
131 6 60
133 26 260
134 1 10
135 10 100
136 6 60
147 11 110
148 0.8 8
161 23 230
162 8 80
175 6 60
189 0.9 9
190 3 30
204 17 170
205 4 40
//
system version 2.2.8-SNAPSHOT