ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009855
RECORD_TITLE: 1-(3,4-DICHLOROPHENYL)UREA; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 1-(3,4-DICHLOROPHENYL)UREA
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H6Cl2N2O
CH$EXACT_MASS: 203.98572
CH$SMILES: NC(=O)Nc(c1)cc(Cl)c(Cl)c1
CH$IUPAC: InChI=1S/C7H6Cl2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12)
CH$LINK: INCHIKEY CYESCLHCWJKRKM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2041468
AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-03di-2900000000-91d498a104c598a75303
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  28 2 20
  43 1.6 16
  44 8.1 81
  52 0.13 1
  61 1.6 16
  62 4.1 41
  63 7.1 71
  64 0.18 2
  72 1.3 13
  73 4.4 44
  74 1.8 18
  75 0.22 2
  88 1.4 14
  89 1.6 16
  90 9.2 92
  91 0.25 3
  97 2.1 21
  98 1.8 18
  99 10 100
  100 0.13 1
  101 3.5 35
  109 1.5 15
  124 3.9 39
  125 0.6 6
  126 10.2 102
  127 2.8 28
  128 3.2 32
  133 0.49 5
  134 3.9 39
  135 3.4 34
  136 2.5 25
  160 0.21 2
  161 99.99 999
  162 64.5 645
  163 4.6 46
  164 1.04 10
  165 8.3 83
  187 3.5 35
  189 2.3 23
  204 2.36 24
  205 2.5 25
  206 15 150
  207 1.3 13
  208 2.6 26
//
