MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009480
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009480
RECORD_TITLE: 9(10H)-ACRIDONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA
CH$NAME: 9(10H)-ACRIDONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H9NO
CH$EXACT_MASS: 195.06841
CH$SMILES: O=C(c21)c(c3)c(ccc3)Nc(cccc2)1
CH$IUPAC: InChI=1S/C13H9NO/c15-13-9-5-1-3-7-11(9)14-12-8-4-2-6-10(12)13/h1-8H,(H,14,15)
CH$LINK: CAS
578-95-0
CH$LINK: INCHIKEY
FZEYVTFCMJSGMP-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8060371
AC$INSTRUMENT: HITACHI M-80
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: splash10-00kb-3900000000-cb9f42be169c6b6da934
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
18 1.84 18
27 1.18 12
28 3.58 36
38 2.02 20
39 4.03 40
50 6.16 62
51 3.6 36
52 2.08 21
62 2.84 28
63 7.24 72
64 3.85 39
65 1.79 18
69 2.03 20
70 1.21 12
71 2.27 23
74 4.02 40
75 4.38 44
76 5.23 52
77 3.56 36
83 1.61 16
84 7.88 79
86 1.21 12
87 2.31 23
88 1.84 18
89 2.45 25
90 1.78 18
91 1.14 11
92 2.27 23
97 2.16 22
101 1.05 11
102 1.45 15
113 3.92 39
114 2.37 24
115 2.89 29
137 1.13 11
138 1.97 20
139 14.78 148
140 12.62 126
141 2.01 20
164 3.16 32
165 2.22 22
166 19.1 191
167 40.8 408
168 5.58 56
194 3.3 33
195 99.99 999
196 14.98 150
197 1.14 11
//