ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005597
RECORD_TITLE: 1-BENZENESULFONYL-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$NAME: 1-BENZENESULFONYL-5-FLUOROURACIL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H7FN2O4S
CH$EXACT_MASS: 270.01106
CH$SMILES: O=C(N2)C(F)=C([H])N(C(=O)2)S(=O)(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C10H7FN2O4S/c11-8-6-13(10(15)12-9(8)14)18(16,17)7-4-2-1-3-5-7/h1-6H,(H,12,14,15)
CH$LINK: INCHIKEY ZZDRJVSCQGYTCG-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:555622
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$SPLASH: splash10-004l-9520000000-f36ef22e353115b02bc9
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  29 5 50
  38 5 50
  43 2 20
  44 0.08 1
  45 1 10
  50 12 120
  51 28 280
  52 0.05 1
  58 11 110
  74 5 50
  75 5 50
  76 0.05 1
  77 99.99 999
  78 19 190
  87 5 50
  91 0.03 0
  94 6 60
  97 4 40
  104 5 50
  114 0.05 1
  115 5 50
  116 5 50
  125 7 70
  130 0.05 1
  134 1 10
  135 2 20
  141 81 810
  142 0.14 1
  143 12 120
  163 5 50
  206 33 330
  207 0.09 1
  270 16 160
  271 5 50
//
