MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010791
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010791
RECORD_TITLE: DIBENZOFURAN; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FUJISE Y, HAMAMATSU UNIV. SCHOOL OF MEDICINE
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$LINK: INCHIKEY
TXCDCPKCNAJMEE-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2021993
AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-014i-2900000000-47fc32972159b3a0a9a2
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
50 1.23 12
51 1.62 16
62 1.65 17
63 3.54 35
69 5.44 54
70 2.9 29
74 1.48 15
75 1.46 15
84 12.87 129
87 1.67 17
88 1.28 13
89 1.75 18
113 2.17 22
114 2.29 23
139 21.01 210
140 3.05 31
168 99.99 999
169 13.51 135
//
system version 2.2.6-SNAPSHOT