MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008779
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008779
RECORD_TITLE: 9,10-DIBROMOANTHRACENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
LICENSE: CC BY-NC-SA
CH$NAME: 9,10-DIBROMOANTHRACENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H8Br2
CH$EXACT_MASS: 333.89928
CH$SMILES: c(c3)cc(c(Br)1)c(c3)c(Br)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C14H8Br2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H
CH$LINK: CAS
523-27-3
CH$LINK: INCHIKEY
BRUOAURMAFDGLP-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5049312
AC$INSTRUMENT: HP 5970
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: splash10-002r-7908000000-ea2eaf25e408bd2ba03c
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
43 6.1 61
44 12.03 120
62 13.79 138
63 9.68 97
74 17.08 171
75 21.53 215
86 10.52 105
87 21.06 211
88 51.64 516
89 5.76 58
98 13.18 132
111 7.24 72
149 9.45 95
150 17.46 175
168 15.75 158
174 18.78 188
175 24.89 249
176 99.99 999
177 16.42 164
334 47.69 477
336 79.33 793
337 17.46 175
338 42.15 422
339 8.19 82
//