MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000496
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000496
RECORD_TITLE: 6-HYDROXYQUINOLINE; 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$NAME: 6-HYDROXYQUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H7NO
CH$EXACT_MASS: 145.05276
CH$SMILES: Oc(c1)cc(c2)c(ncc2)c1
CH$IUPAC: InChI=1S/C9H7NO/c11-8-3-4-9-7(6-8)2-1-5-10-9/h1-6,11H
CH$LINK: COMPTOX
DTXSID40206726
CH$LINK: INCHIKEY
OVYWMEWYEJLIER-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:11374
AC$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: splash10-0005-9700000000-deefb30abd0fb428f1ef
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
30 3.5 35
31 6.9 69
38 6.3 63
39 1.34 13
40 37.8 378
41 8.1 81
42 4.6 46
43 1.18 12
45 6.7 67
50 6 60
51 5.8 58
52 0.46 5
53 6.3 63
54 3.2 32
55 4.8 48
56 0.39 4
57 4.8 48
59 3.9 39
62 6.7 67
63 1.76 18
64 7.6 76
65 3.8 38
66 3 30
67 0.32 3
68 2.3 23
69 3.2 32
70 2.1 21
71 0.23 2
72 1.9 19
74 3.2 32
75 4.2 42
76 0.21 2
77 3 30
79 3 30
87 2.5 25
88 0.25 3
89 22.4 224
90 23.4 234
91 6.7 67
92 0.28 3
116 13 130
117 28.2 282
118 7.9 79
119 0.32 3
144 8.1 81
145 99.99 999
146 11.1 111
//