MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007403
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007403
RECORD_TITLE: TETRAHYDROQUINOLINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: TETRAHYDROQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H11N
CH$EXACT_MASS: 133.08915
CH$SMILES: C(C2)Cc(c1)c(N2)ccc1
CH$IUPAC: InChI=1S/C9H11N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-2,4,6,10H,3,5,7H2
CH$LINK: CAS
25448-04-8
CH$LINK: INCHIKEY
LBUJPTNKIBCYBY-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8060903
AC$INSTRUMENT: HITACHI RMU-6M
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: splash10-00lr-6900000000-3839cfb7c6ab6e9308da
PK$NUM_PEAK: 51
PK$PEAK: m/z int. rel.int.
18 32.3 323
27 4.9 49
28 4.5 45
29 0.41 4
39 2.1 21
40 7.6 76
41 1.1 11
42 0.19 2
50 5.6 56
51 13.1 131
52 5.6 56
53 0.23 2
54 1.3 13
59 1.9 19
62 1.8 18
63 0.46 5
64 2.4 24
64.5 4.8 48
65 8.6 86
65.5 0.9 9
66 3.2 32
66.5 4.8 48
67 1 10
74 0.21 2
75 2.4 24
76 3.1 31
77 16.7 167
78 0.97 10
79 4.3 43
89 2.7 27
90 3.2 32
91 0.86 9
92 1.2 12
101 1 10
102 3.1 31
103 0.56 6
104 10.3 103
105 6.5 65
106 3.1 31
115 0.45 5
116 1.6 16
117 19.2 192
118 25.1 251
119 0.24 2
128 1.4 14
129 1.7 17
130 14 140
131 0.64 6
132 99.99 999
133 9.41 94
134 9.3 93
//