MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000493
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000493
RECORD_TITLE: 6-METHYLQUINOLINE; 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$NAME: 6-METHYLQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H9N
CH$EXACT_MASS: 143.07350
CH$SMILES: Cc(c1)cc(c2)c(ncc2)c1
CH$IUPAC: InChI=1S/C10H9N/c1-8-4-5-10-9(7-8)3-2-6-11-10/h2-7H,1H3
CH$LINK: INCHIKEY
LUYISICIYVKBTA-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3020887
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$SPLASH: splash10-0006-5900000000-d22c6c5ed754f74aacaa
PK$NUM_PEAK: 50
PK$PEAK: m/z int. rel.int.
18 4.6 46
26 2.5 25
27 4.1 41
28 0.18 2
29 1.1 11
37 1.2 12
38 2.4 24
39 0.57 6
40 2.5 25
41 1.3 13
42 4.3 43
43 4.71 47
44 2.1 21
50 3.4 34
51 4.7 47
52 0.16 2
57 1 10
57.5 1.7 17
58 15.1 151
58.5 0.39 4
62 3.1 31
63 10.9 109
64 2.2 22
65 0.24 2
70.5 2.4 24
71.5 2.9 29
74 2.3 23
75 0.35 4
76 2.7 27
77 1.8 18
78 1 10
87 0.14 1
88 2 20
89 7.8 78
90 2.3 23
101 0.15 2
102 3.3 33
103 1.1 11
113 2 20
114 0.32 3
115 17.3 173
116 7.8 78
117 5.2 52
128 0.24 2
129 8.9 89
140 3.1 31
141 9.5 95
142 5.29 53
143 99.99 999
144 11.2 112
//
system version 2.2.6-SNAPSHOT