ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009605
RECORD_TITLE: 4-FLUOROPHENYL METHYL KETONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: THE INSTITUTE OF SCIENTIFIC AND INDUSTRIALRESEARCH
LICENSE: CC BY-NC-SA
CH$NAME: 4-FLUOROPHENYL METHYL KETONE
CH$NAME: 4-FLUOROACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H7FO
CH$EXACT_MASS: 138.04809
CH$SMILES: CC(=O)c(c1)ccc(F)c1
CH$IUPAC: InChI=1S/C8H7FO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
CH$LINK: INCHIKEY ZDPAWHACYDRYIW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0059952
AC$INSTRUMENT: JEOL JMS-DX-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: splash10-00dj-9500000000-c58704fe6b4a81c62298
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  26 1.7 17
  27 2 20
  28 10.3 103
  29 0.22 2
  31 4 40
  32 2.2 22
  33 1.1 11
  37 0.22 2
  38 4.3 43
  39 6.7 67
  42 7 70
  43 4.02 40
  44 1.5 15
  45 1.6 16
  49 2 20
  50 2.13 21
  51 12.2 122
  56 1.8 18
  57 9.9 99
  61 0.35 4
  62 6.1 61
  63 8 80
  68 7.3 73
  69 1.32 13
  70 3 30
  73 2 20
  74 14.9 149
  75 5.45 55
  76 6 60
  81 3.8 38
  83 6 60
  86 0.1 1
  87 1 10
  92 1.7 17
  93 2.7 27
  94 0.88 9
  95 90.9 909
  96 9 90
  107 3.2 32
  109 0.49 5
  123 99.99 999
  124 7.7 77
  138 29 290
  139 3.2 32
//
