MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010927
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010927
RECORD_TITLE: 4-METHOXY-2-METHYL-1,3-OCTADIENE; 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$NAME: 4-METHOXY-2-METHYL-1,3-OCTADIENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: CCCCC(OC)=CC(C)=C
CH$IUPAC: InChI=1S/C10H18O/c1-5-6-7-10(11-4)8-9(2)3/h8H,2,5-7H2,1,3-4H3/b10-8-
CH$LINK: INCHIKEY
LRUTXLRHMKGBCN-NTMALXAHSA-N
AC$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: splash10-004i-9500000000-db784a277187d5eaf6da
PK$NUM_PEAK: 94
PK$PEAK: m/z int. rel.int.
26 0.8 8
27 16.6 166
28 93.4 934
29 16.3 163
30 0.4 4
31 2.9 29
32 26.8 268
38 1 10
39 18.1 181
40 4.2 42
41 36.6 366
42 4.3 43
43 17.6 176
44 1 10
45 26.3 263
50 1.7 17
51 3.7 37
52 2.2 22
53 14.8 148
54 3.3 33
55 30.2 302
56 2.5 25
57 11.7 117
58 3.3 33
59 10.4 104
63 0.6 6
65 5.4 54
66 2 20
67 20.9 209
68 3.9 39
69 13.3 133
70 1 10
71 5.7 57
72 5.2 52
73 2.3 23
74 1.3 13
75 2.1 21
77 30 300
78 3.8 38
79 25.5 255
80 3.8 38
81 16.5 165
82 5.2 52
83 15.7 157
84 1.3 13
85 12.3 123
86 1.2 12
87 0.8 8
91 19.9 199
92 2 20
93 41.4 414
94 4.4 44
95 14.2 142
96 3.9 39
97 28.1 281
98 5.5 55
99 4 40
101 3.9 39
102 1 10
103 1 10
105 2.6 26
106 0.4 4
107 13.1 131
108 1.3 13
109 4.4 44
110 5.8 58
111 32.3 323
112 10.4 104
113 1 10
119 2 20
120 0.8 8
121 2 20
122 2.1 21
123 5.2 52
124 1.4 14
125 99.99 999
126 9.7 97
127 0.7 7
129 7.8 78
133 32.3 323
134 2.1 21
135 10.5 105
136 0.8 8
137 1 10
139 66.6 666
140 7.2 72
141 1 10
153 2.8 28
154 34.9 349
155 5.5 55
162 0.4 4
163 1.2 12
177 0.8 8
178 0.7 7
//