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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001507

DIPHENYL ETHER; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001507
RECORD_TITLE: DIPHENYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: DIPHENYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10O
CH$EXACT_MASS: 170.07316
CH$SMILES: c(c2)ccc(c2)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C12H10O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H
CH$LINK: INCHIKEY USIUVYZYUHIAEV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9021847

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-00dl-6900000000-1b320b4ab1b86a9f7013
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  27 3.75 38
  28 2.17 22
  38 3.62 36
  39 15.52 155
  40 1.68 17
  50 9.03 90
  51 37.16 372
  52 2.21 22
  55 1.72 17
  57.5 1.64 16
  58 1.2 12
  62 1.6 16
  63 5.22 52
  64 2.34 23
  65 6.97 70
  66 1.14 11
  70 3.82 38
  70.5 1.44 14
  71 5.07 51
  74 2.37 24
  75 1.92 19
  76 2.3 23
  77 37.16 372
  78 2.74 27
  84 1.1 11
  85 3.15 32
  89 1.07 11
  94 4.86 49
  115 11.24 112
  116 2.02 20
  139 2.26 23
  140 1.46 15
  141 36.62 366
  142 26.84 268
  143 3.18 32
  168 2.2 22
  169 15.83 158
  170 99.99 999
  171 13.76 138
  172 1.26 13
//

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