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Back ChemicalBook Home>CAS DataBase List>57-66-9More Spectrum> Probenecid(57-66-9) IR1

57-66-9

Probenecid(57-66-9) IR1

Product NameProbenecid

CAS57-66-9

Molecular FormulaC13H19NO4S

Molecular Weight285.36

InChIInChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16)

InChIKey DBABZHXKTCFAPX-UHFFFAOYSA-N

SmilesC(O)(=O)C1=CC=C(S(N(CCC)CCC)(=O)=O)C=C1

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MS

1HNMR

IR1

IR2

  • Probenecid(57-66-9) IR1
    Mass 

    MS-IW-1714          
p-(dipropylsulfamoyl)benzoic acid
C13H19NO4S          (Mass of molecular ion:    285)


       Source Temperature: 210 °C
   Sample Temperature: 150 °C
   Direct, 75 eV


          27.0       2.2
      28.0       1.0
      30.0       1.7
      39.0       1.8
      41.0       4.4
      42.0       4.7
      43.0       6.2
      51.0       1.0
      58.0       1.2
      65.0       7.9
      70.0       3.5
      75.0       1.0
      76.0       2.5
      77.0       1.0
      93.0       1.2
     121.0      28.8
     122.0       2.4
     185.0      33.5
     186.0       2.9
     187.0       1.9
     214.0      10.0
     215.0       1.0
     256.0     100.0
     257.0      13.6
     258.0       6.0
     285.0       4.8

  • Probenecid(57-66-9) IR1

KBr disc

  • Probenecid(57-66-9) IR1

nujol mull

  • Probenecid(57-66-9) IR1

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