MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004382
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004382
RECORD_TITLE: 6,8-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE; 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$NAME: 6,8-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H15N
CH$EXACT_MASS: 161.12045
CH$SMILES: Cc(c1)cc(C2)c(NCC2)c(C)1
CH$IUPAC: InChI=1S/C11H15N/c1-8-6-9(2)11-10(7-8)4-3-5-12-11/h6-7,12H,3-5H2,1-2H3
CH$LINK: INCHIKEY
IIYDCBDQCBTBFF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID60496824
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$SPLASH: splash10-08fr-3900000000-a8c1022ae4c771ad6e02
PK$NUM_PEAK: 116
PK$PEAK: m/z int. rel.int.
15 1.6 16
16 1.2 12
17 8 80
18 2.96 30
26 2.1 21
27 6.9 69
29 2.5 25
30 0.12 1
31 1.1 11
38 2.3 23
39 13.9 139
40 0.21 2
41 6.6 66
42 2.1 21
43 2.8 28
45 0.14 1
50 4.8 48
51 12.8 128
52 5.3 53
53 0.43 4
54 2.1 21
55 3 30
56 1.8 18
57 0.18 2
57.5 1.2 12
58.5 2.1 21
60 1.1 11
61 0.11 1
62 3 30
63 9.8 98
63.5 1.2 12
64 0.41 4
64.5 3.4 34
65 11.9 119
65.5 5.2 52
66.5 0.18 2
67 2.3 23
68 1.2 12
69 1.6 16
70 0.11 1
70.5 1.6 16
71 1.4 14
71.5 4.6 46
72 0.25 3
72.5 3.2 32
73 1.4 14
74 2.3 23
75 0.43 4
76 4.1 41
76.5 1.9 19
77 20.9 209
77.5 0.39 4
78 9.9 99
78.5 4.8 48
79 6.8 68
79.5 0.53 5
80 2.1 21
80.5 2.3 23
81 1.9 19
86 0.11 1
87 1.8 18
88 1.6 16
89 6.6 66
90 0.37 4
91 14.4 144
92 3 30
93 2.1 21
94 0.16 2
95 1.2 12
98 1.1 11
100 1.1 11
101 0.34 3
102 6.2 62
103 9.1 91
104 7.1 71
105 0.59 6
106 4.1 41
107 1.4 14
113 1.6 16
114 0.27 3
115 13.7 137
116 6.4 64
117 16.6 166
118 1.01 10
119 2.8 28
120 3 30
121 2.5 25
126 0.12 1
127 6.2 62
128 12.1 121
129 11.2 112
130 1.39 14
131 20.5 205
132 31.7 317
134 3.9 39
140 0.27 3
141 7.8 78
142 38.9 389
143 9.9 99
144 2.22 22
145 23 230
146 40.3 403
147 5.3 53
148 0.11 1
152 1.2 12
153 1.2 12
154 11.3 113
155 0.43 4
156 33.1 331
157 83.5 835
158 21.8 218
159 0.69 7
160 78.9 789
161 99.99 999
162 11.8 118
163 1.4 14
//