MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010119
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010119
RECORD_TITLE: 1,2-EPOXY-3,7,11-TRIMETHYL-(6Z,10)-DODECADIENE-3-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 1,2-EPOXY-3,7,11-TRIMETHYL-(6Z,10)-DODECADIENE-3-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H26O2
CH$EXACT_MASS: 238.19328
CH$SMILES: CC(C)=CCCC(C)=C([H])CCC(C)(O)C(O1)C1
CH$IUPAC: InChI=1S/C15H26O2/c1-12(2)7-5-8-13(3)9-6-10-15(4,16)14-11-17-14/h7,9,14,16H,5-6,8,10-11H2,1-4H3/b13-9-
CH$LINK: INCHIKEY
CLIDOAFOSTWHAW-LCYFTJDESA-N
AC$INSTRUMENT: JEOL JMS-D-300
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: splash10-067j-9100000000-8970c00ae3053ce09bd8
PK$NUM_PEAK: 79
PK$PEAK: m/z int. rel.int.
27 6 60
28 5 50
29 9 90
31 0.6 6
39 5 50
41 46 460
42 4 40
43 5.8 58
44 10 100
45 73 730
52 0.2 2
53 6 60
55 31 310
56 2 20
57 2 20
58 1.6 16
59 31 310
65 2 20
67 26 260
68 0.4 4
69 99.99 999
70 8 80
71 7 70
72 0.6 6
73 33 330
74 15 150
75 3 30
77 0.2 2
79 6 60
81 24 240
82 84 840
83 2.3 23
84 2 20
85 3 30
87 15 150
88 0.5 5
89 26 260
90 2 20
91 2 20
93 0.5 5
94 6 60
95 33 330
96 6 60
97 0.6 6
99 4 40
101 4 40
103 10 100
105 0.2 2
107 6 60
108 4 40
109 28 280
110 0.4 4
113 9 90
114 2 20
115 2 20
116 0.2 2
117 4 40
121 7 70
122 2 20
123 1.3 13
124 3 30
127 2 20
131 3 30
133 0.8 8
135 8 80
139 3 30
147 2 20
149 0.7 7
150 6 60
151 6 60
153 10 100
159 0.2 2
164 6 60
165 3 30
177 3 30
191 1.7 17
192 2 20
209 14 140
220 1.8 18
//