ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005116
RECORD_TITLE: 4-PHENYLAMINO-2(5H)-FURANONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, FAC. OF SCIENCE AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 4-PHENYLAMINO-2(5H)-FURANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₉NO₂
CH$EXACT_MASS: 175.06333
CH$SMILES: O=C(O2)C=C(C2)Nc(c1)cccc1
CH$IUPAC: InChI=1S/C10H9NO2/c12-10-6-9(7-13-10)11-8-4-2-1-3-5-8/h1-6,11H,7H2
CH$LINK: INCHIKEY CMEWGTYCQMDKHR-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40176819

AC$INSTRUMENT: JEOL JMS-HX-100
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 23 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-004i-0900000000-d320bb2dc4055824d29d
PK$NUM_PEAK: 61
PK$PEAK: m/z int. rel.int.
  55 1.48 15
  56 0.83 8
  57 0.79 8
  61 0.46 5
  68 1.36 14
  69 0.58 6
  70 0.48 5
  71 0.75 8
  77 0.63 6
  78 0.74 7
  81 0.62 6
  82 0.66 7
  83 0.76 8
  84 0.88 9
  85 0.99 10
  90 1.44 14
  91 2.38 24
  92 0.46 5
  93 1 10
  94 0.44 4
  95 0.78 8
  96 0.39 4
  97 0.64 6
  98 0.44 4
  99 0.45 5
  104 1.02 10
  106 0.67 7
  107 1.45 15
  109 0.6 6
  111 0.54 5
  112 0.81 8
  113 6.46 65
  114 0.49 5
  116 0.87 9
  117 7.87 79
  118 16.75 168
  119 2.39 24
  120 0.4 4
  123 0.51 5
  124 0.4 4
  125 0.48 5
  129 0.6 6
  130 6.67 67
  131 1.29 13
  132 0.4 4
  133 0.49 5
  136 0.55 6
  137 0.57 6
  144 6.26 63
  145 0.93 9
  146 5.68 57
  147 2.63 26
  148 0.37 4
  149 1.2 12
  153 0.35 4
  158 0.49 5
  167 0.62 6
  174 6.44 64
  175 99.99 999
  176 12.04 120
  177 1.24 12
//