4628-39-1

Uracil-4-acetic acid(4628-39-1) IR1

Product NameUracil-4-acetic acid

CAS 4628-39-1

Molecular FormulaC6H6N2O4

Molecular Weight170.12

InChIInChI=1S/C6H6N2O4/c9-4-1-3(2-5(10)11)7-6(12)8-4/h1H,2H2,(H,10,11)(H2,7,8,9,12)

InChIKey NQAUNZZEYKWTHM-UHFFFAOYSA-N

SmilesC1(=O)NC(=O)C=C(CC(O)=O)N1

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¹HNMR

IR1

IR2

400 MHz in CDCl3

Uracil-4-acetic acid(4628-39-1) IR1

¹H NMR	399.65 MHz
C₆ H₆ N₂ O₄	0.038 g : 0.5 ml DMSO-d₆
2,6-dihydroxy-4-pyrimidineacetic acid

    Assign.     Shift(ppm)

      A            12.
      B     *1     11.015
      C     *1     10.884
      D             5.464
      E             3.405

     Hz     ppm     Int.

   4402.53  11.016    218
   4349.96  10.885    237
   2184.06   5.465    401
   1361.17   3.406   1000

KBr disc

nujol mull

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