MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009458
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009458
RECORD_TITLE: ACRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: EGUCHI S, FAC. OF SCIENCE, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ACRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H9N
CH$EXACT_MASS: 179.07350
CH$SMILES: c(c3)cc(c1)c(c3)nc(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C13H9N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-9H
CH$LINK: INCHIKEY
DZBUGLKDJFMEHC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8059766
AC$INSTRUMENT: HITACHI RMU-7L
AC$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$SPLASH: splash10-0fb9-7900000000-21c7ab90106cbfed50b1
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
50 37.5 375
51 24.5 245
52 10.5 105
53 2 20
61 6.5 65
62 15.5 155
63 31.5 315
64 9.5 95
65 5 50
73 2.5 25
74 39.5 395
75 25.5 255
76 24.5 245
77 14 140
78 7.5 75
87 13.5 135
88 7.5 75
89 1.5 15
90 4.5 45
91 3 30
98 13.5 135
99 14 140
100 13.5 135
101 13 130
102 10.5 105
103 8 80
104 3.5 35
105 1 10
111 4 40
112 1.5 15
113 8 80
114 4.5 45
122 3 30
123 2 20
124 1.5 15
125 4 40
126 16 160
127 9 90
128 7.5 75
129 2 20
131 1.5 15
137 2 20
139 3 30
140 7.5 75
149 1.5 15
150 12.5 125
151 27.5 275
152 30.5 305
153 15 150
154 3 30
162 2 20
163 0.5 5
175 1 10
176 2 20
177 7 70
178 17.5 175
179 99.99 999
180 15 150
//