MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002568
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002568
RECORD_TITLE: 1,2,3,4-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$NAME: 1,2,3,4-TETRAHYDROQUINOLINE
CH$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$LINK: INCHIKEY
LBUJPTNKIBCYBY-UHFFFAOYSA-N
CH$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$SPLASH: splash10-001i-3900000000-262a0bef1ef5519e03ae
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
27 4.9 49
28 4.5 45
29 4.1 41
39 0.21 2
40 7.6 76
41 1.1 11
42 1.9 19
50 0.56 6
51 13.1 131
52 5.6 56
53 2.3 23
54 0.13 1
59 1.9 19
62 1.8 18
63 4.6 46
64.5 0.48 5
65 8.6 86
65.5 9 90
66 3.2 32
66.5 0.48 5
67 1 10
74 2.1 21
75 2.4 24
77 1.67 17
78 9.7 97
79 4.3 43
89 2.7 27
90 0.32 3
91 8.6 86
92 1.2 12
101 1 10
102 0.31 3
103 5.6 56
104 10.3 103
105 6.5 65
106 0.31 3
115 4.5 45
116 1.6 16
117 19.2 192
118 2.51 25
119 2.4 24
128 1.4 14
129 1.7 17
130 1.4 14
131 6.4 64
132 99.99 999
133 94.1 941
134 9.3 93
//