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51-21-8

5-Fluorouracil

Product Name 5-Fluorouracil

CAS51-21-8

MFC4H3FN2O2

MW130.08

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  • 51-21-8_ms
    Mass

    MS-NW-5016          
    5-fluoro-2,4(1H,3H)-pyrimidinedione
    C4H3FN2O2           (Mass of molecular ion:    130)
    

       Source Temperature: 130 °C
       Sample Temperature: 110 °C
       Direct, 75 eV
    

          17.0       2.0
          18.0       8.8
          26.0       1.0
          27.0       2.9
          28.0      46.9
          29.0       1.4
          31.0       9.7
          32.0       3.1
          38.0       1.5
          39.0       2.1
          40.0       1.8
          41.0       1.8
          42.0       1.6
          43.0       5.7
          44.0       7.1
          51.0       1.1
          53.0       1.4
          57.0       1.7
          58.0       7.4
          59.0      10.0
          60.0      34.1
          61.0       1.1
          70.0       3.1
          74.0       1.4
          80.0       1.6
          86.0       1.6
          87.0      42.5
          88.0       6.0
         130.0     100.0
         131.0       5.7
    

parameter in DMSO-d6+HCl

  • 51-21-8_1hnmr

    1H NMR 300 MHz
    C4 H3 F N2 O2 12 % in DMSO-d6+HCl
    5-fluoro-2,4(1H,3H)-pyrimidinedione
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 7.73 D(B) 11.46 J(A,B) 5.9 J(A,X) 6.1 J(B,X) 0.0 D(C) 10.70 KOKKO,J.P. ET AL. J.AM.CHEM.SOC. 84, 1042 (1962) ACLIDIFIED BY PASSING ONE BUBBLE OF ANHYDROVS HCL THROUGH THE SAMPLE.

         Hz     ppm     Int.
    

       3440.95  11.470    501
       3435.11  11.450    506
       3210.00  10.700   1000
       2324.98   7.750    255
       2319.00   7.730    482
       2313.03   7.710    253
    

KBr disc

  • 51-21-8_ir1_2

nujol mull

  • 51-21-8_ir2

  • 51-21-8_raman

TI(III) COMPLEX IN C6H6/C6H5(CH3), 77K

  • 51-21-8_esr_0