MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010828
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010828
RECORD_TITLE: 5-AMINOQUINOLINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA
CH$NAME: 5-AMINOQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H8N2
CH$EXACT_MASS: 144.06875
CH$SMILES: Nc(c1)c(c2)c(ncc2)cc1
CH$IUPAC: InChI=1S/C9H8N2/c10-8-4-1-5-9-7(8)3-2-6-11-9/h1-6H,10H2
CH$LINK: COMPTOX
DTXSID80209978
CH$LINK: INCHIKEY
XMIAFAKRAAMSGX-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:11911
AC$INSTRUMENT: JEOL JMS-AX-505-H
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: splash10-0006-3900000000-bcb18a2e0047e208d2bd
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
51 4.05 41
55 1.7 17
60 1.23 12
62 3.38 34
63 4.78 48
67 1.17 12
70 1.96 20
71 2.59 26
72 2.37 24
73 3.33 33
74 1.96 20
75 1.33 13
76 1.32 13
84 1.45 15
85 3.37 34
87 1.72 17
88 1.27 13
89 10.61 106
90 7.98 80
91 8.73 87
97 1.03 10
98 1.03 10
106 5.2 52
114 2 20
115 2.67 27
116 13.6 136
117 22.81 228
118 3.31 33
127 1.54 15
142 2.31 23
143 9.6 96
144 99.99 999
145 10.97 110
149 1.35 14
153 1.18 12
//