ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005586
RECORD_TITLE: 1-PHENOXYMETHYL-5-FLUOROURACIL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 1-PHENOXYMETHYL-5-FLUOROURACIL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H9FN2O3
CH$EXACT_MASS: 236.05972
CH$SMILES: O=C(N1)C(F)=CN(COc(c2)cccc2)C(=O)1
CH$IUPAC: InChI=1S/C11H9FN2O3/c12-9-6-14(11(16)13-10(9)15)7-17-8-4-2-1-3-5-8/h1-6H,7H2,(H,13,15,16)
CH$LINK: INCHIKEY QSWJBPPMMVWPBT-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-01-SG-2
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-8900000000-e558f17de3005a9bccc9
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  38 4 40
  39 12 120
  40 3 30
  41 0.04 0
  44 5 50
  45 13 130
  50 4 40
  51 0.11 1
  52 10 100
  62 2 20
  63 5 50
  64 0.03 0
  65 13 130
  66 7 70
  70 4 40
  71 0.05 1
  72 12 120
  77 20 200
  78 4 40
  79 0.06 1
  87 3 30
  93 5 50
  94 62 620
  95 0.08 1
  100 76 760
  101 9 90
  107 11 110
  114 0.06 1
  141 3 30
  142 12 120
  143 99.99 999
  236 0.51 5
  237 14 140
//
