MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010674
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010674
RECORD_TITLE: ALPHA-SELINENE; 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$NAME: ALPHA-SELINENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H24
CH$EXACT_MASS: 204.18780
CH$SMILES: CC(=C)C([H])(C1)CC([H])(C(C)=2)C(C)(CCC([H])2)C1
CH$IUPAC: InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14+,15-/m1/s1
CH$LINK: INCHIKEY
OZQAPQSEYFAMCY-QLFBSQMISA-N
AC$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: splash10-0a5c-9710000000-e1b9585bb66b7f1d718b
PK$NUM_PEAK: 67
PK$PEAK: m/z int. rel.int.
41 85 850
42 6 60
43 23 230
51 0.6 6
52 4 40
53 38 380
54 4 40
55 5.7 57
56 4 40
57 8 80
65 27 270
66 0.6 6
67 53 530
68 11 110
69 34 340
70 0.4 4
77 40 400
78 9 90
79 70 700
80 1.5 15
81 87 870
82 13 130
83 8 80
91 7.7 77
92 19 190
93 99.99 999
94 28 280
95 5.3 53
96 8 80
97 8 80
103 6.5 65
104 0.4 4
105 85.5 855
106 24 240
107 79 790
108 3.6 36
109 47 470
110 8 80
115 6.5 65
117 0.9 9
118 4 40
119 45.5 455
120 23 230
121 3.2 32
122 26 260
123 23 230
124 4 40
131 1.3 13
132 4 40
133 57 570
134 18 180
135 1.7 17
136 8 80
137 4 40
145 9 90
146 0.4 4
147 32.5 325
148 13 130
149 13 130
161 6.1 61
162 21.5 215
175 21 210
176 6 60
189 5.5 55
190 9 90
204 68 680
205 15.5 155
//