ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000221
RECORD_TITLE: ORTHO FLUORO NITROBENZENE; 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$NAME: ORTHO FLUORO NITROBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₄FNO₂
CH$EXACT_MASS: 141.02261
CH$SMILES: [O-1][N+1](=O)c(c1)c(F)ccc1
CH$IUPAC: InChI=1S/C6H4FNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H
CH$LINK: INCHIKEY PWKNBLFSJAVFAB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1061730

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$SPLASH: splash10-005d-9200000000-3d425de96a111549d2bb
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  27 1.65 17
  30 25.09 251
  31 2.87 29
  37 3.01 30
  38 3.51 35
  39 5.45 55
  41 1.43 14
  49 2.15 22
  50 16.63 166
  51 10.75 108
  56 1.94 19
  57 15.91 159
  61 2.94 29
  62 3.51 35
  63 5.16 52
  65 2.37 24
  68 10.25 103
  69 15.91 159
  73 1.86 19
  74 12.97 130
  75 99.99 999
  76 7.52 75
  81 1.86 19
  82 1.86 19
  83 49.46 495
  84 2.8 28
  92 3.3 33
  93 3.37 34
  94 8.03 80
  95 74.55 746
  96 5.02 50
  111 35.13 351
  112 2.08 21
  120 5.38 54
  121 1.65 17
  125 3.58 36
  141 69.17 692
  142 5.45 55
//