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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006799

BENZOYL FLUORIDE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006799
RECORD_TITLE: BENZOYL FLUORIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: BENZOYL FLUORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H5FO
CH$EXACT_MASS: 124.03244
CH$SMILES: O=C(F)c(c1)cccc1
CH$IUPAC: InChI=1S/C7H5FO/c8-7(9)6-4-2-1-3-5-6/h1-5H
CH$LINK: INCHIKEY HPMLGNIUXVXALD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5060019

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0kka-9400000000-39a9038071ab6fa6ec7a
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  27 3.64 36
  37 5.16 52
  38 6.87 69
  39 8.72 87
  47 1.98 20
  49 4.36 44
  50 36.02 360
  51 47.06 471
  52 5.49 55
  57 2.64 26
  61 1.59 16
  62 2.12 21
  63 3.3 33
  69 2.84 28
  70 13.68 137
  73 2.84 28
  74 13.22 132
  75 13.75 138
  76 14.41 144
  77 62.79 628
  78 16.39 164
  95 7.73 77
  96 99.99 999
  97 6.21 62
  104 1.32 13
  105 64.44 644
  106 4.63 46
  122 8.33 83
  123 13.81 138
  124 83.61 836
  125 7.27 73
//

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