MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002851
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002851
RECORD_TITLE: EPSILON-MUUROLENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: EPSILON-MUUROLENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H24
CH$EXACT_MASS: 204.18780
CH$SMILES: C=C(C2)CC([H])(C([H])(C(C)C)1)C([H])(C2)C(=C)CC1
CH$IUPAC: InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h10,13-15H,3-9H2,1-2H3/t13-,14+,15-/m0/s1
CH$LINK: INCHIKEY
NOLWRMQDWRAODO-ZNMIVQPWSA-N
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9500000000-4c561af72076f5fd5a12
PK$NUM_PEAK: 97
PK$PEAK: m/z int. rel.int.
15 0.8 8
17 1.3 13
18 6.2 62
26 0.13 1
27 26.2 262
28 4.7 47
29 20.7 207
31 0.13 1
39 29.6 296
40 6.8 68
41 90 900
42 0.46 5
43 34 340
44 1.2 12
50 1 10
51 0.61 6
52 3.8 38
53 25.1 251
54 3.6 36
55 4.05 41
56 3 30
57 8 80
59 1 10
63 0.02 0
64 1.1 11
65 15.3 153
66 5.2 52
67 5.25 53
68 4.5 45
69 35 350
70 2.3 23
71 0.26 3
75 1.5 15
77 43.8 438
78 11.7 117
79 6.91 69
80 26.3 263
81 99.99 999
82 11.3 113
83 0.55 6
89 1.3 13
90 0.8 8
91 81 810
92 0.23 2
93 76.8 768
94 16.3 163
95 22 220
96 0.21 2
97 1.2 12
102 0.8 8
103 4.3 43
104 0.05 1
105 72.2 722
106 18.5 185
107 29.6 296
108 0.53 5
109 6.5 65
110 1 10
115 4.6 46
116 0.02 0
117 8 80
118 2.8 28
119 48.2 482
120 0.22 2
121 12 120
122 4.5 45
123 10.7 107
124 0.16 2
127 1.1 11
128 1.8 18
129 1.7 17
130 0.08 1
131 4.3 43
132 2.1 21
133 32.8 328
134 0.85 9
135 32.8 328
136 11 110
137 27.3 273
138 0.26 3
145 2.5 25
146 0.8 8
147 8.8 88
148 2.51 25
149 6.1 61
150 2 20
159 1.2 12
160 0.56 6
161 14 140
162 34 340
163 2.6 26
175 0.31 3
176 4.7 47
189 7.5 75
190 1 10
204 4.61 46
205 7 70
//