MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001595
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001595
RECORD_TITLE: DIBENZOFURAN; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA
CH$NAME: DIBENZOFURAN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H8O
CH$EXACT_MASS: 168.05751
CH$SMILES: c(c3)cc(o1)c(c3)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C12H8O/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H
CH$LINK: CAS
132-64-9
CH$LINK: INCHIKEY
TXCDCPKCNAJMEE-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2021993
AC$INSTRUMENT: VARIAN MAT-44
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: splash10-014i-6900000000-0c0a9a11bac54cd997e0
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
50 5.13 51
51 5.92 59
53 1.18 12
61 1.18 12
62 6.32 63
63 13.83 138
64 1.97 20
65 1.18 12
69 16.6 166
70 14.22 142
74 5.13 51
75 4.74 47
84 29.64 296
86 3.55 36
87 2.76 28
88 3.55 36
89 5.53 55
90 1.18 12
113 3.55 36
114 3.16 32
138 1.58 16
139 28.45 285
140 5.92 59
167 1.97 20
168 99.99 999
169 14.22 142
170 1.58 16
//
system version 2.2.6-SNAPSHOT