MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004349
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004349
RECORD_TITLE: 7,8-ETHYLENE-3A,8A-DIMETHYL-2,3,3A,8A-TETRAHYDROPYRROLO(2,3-B)INDOLE; 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$NAME: 7,8-ETHYLENE-3A,8A-DIMETHYL-2,3,3A,8A-TETRAHYDROPYRROLO(2,3-B)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H18N2
CH$EXACT_MASS: 214.14700
CH$SMILES: c(c2)cc(c31)C(C)(C4)C(C)(NC4)N(CCc23)1
CH$IUPAC: InChI=1S/C14H18N2/c1-13-7-8-15-14(13,2)16-9-6-10-4-3-5-11(13)12(10)16/h3-5,15H,6-9H2,1-2H3
CH$LINK: INCHIKEY
FVPWHJVDXZFCBO-UHFFFAOYSA-N
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-05fr-2910000000-b691f6e5382d54bd5fdd
PK$NUM_PEAK: 104
PK$PEAK: m/z int. rel.int.
30 4 40
40 2.8 28
41 11.5 115
42 1.22 12
43 3.1 31
50 3.4 34
51 8.4 84
52 0.46 5
53 5.2 52
54 6.8 68
55 19.5 195
56 0.88 9
58.5 3.8 38
62 2.8 28
63 9.3 93
64 0.39 4
65 10 100
66 2.2 22
67 2.3 23
68 0.19 2
75 2.6 26
76 2.8 28
77 2 20
78 0.49 5
79 3 30
80 4.3 43
81 1.7 17
82 0.17 2
88 1.9 19
89 12.8 128
90 11.1 111
91 2.08 21
92 2.8 28
93 2.2 22
94 6.4 64
95 0.42 4
96 5.6 56
97 3.4 34
101 2.2 22
102 0.42 4
103 6.3 63
104 3.3 33
105 2.9 29
114 0.22 2
115 19.9 199
116 9.4 94
117 35.4 354
118 4.67 47
119 21.2 212
120 2.8 28
127 6.3 63
128 1.13 11
129 10 100
130 23.5 235
131 8.7 87
132 1.22 12
133 2.6 26
140 2.2 22
141 6.3 63
142 1.02 10
143 19.5 195
144 30 300
145 10.8 108
146 0.58 6
154 10.6 106
155 7.1 71
156 5 50
157 2.04 20
158 99.99 999
159 20.8 208
160 6.8 68
161 0.15 2
162 1.7 17
167 4 40
168 7 70
169 0.7 7
170 96.7 967
171 40 400
172 70 700
173 2.66 27
174 11.9 119
175 15.5 155
176 2.8 28
182 0.46 5
183 3.3 33
184 12 120
185 7 70
186 1.15 12
187 5 50
188 3.1 31
196 2.3 23
197 0.52 5
198 4.7 47
199 13.3 133
200 3.6 36
201 0.17 2
202 2.1 21
203 1.9 19
210 1.4 14
211 0.13 1
212 6.8 68
213 8.9 89
214 46.7 467
215 9.3 93
//
system version 2.2.6-SNAPSHOT