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Product NameAcetrizoic acid
CAS85-36-9
Molecular FormulaC9H6I3NO3
Molecular Weight556.86
InChIInChI=1S/C9H6I3NO3/c1-3(14)13-8-5(11)2-4(10)6(7(8)12)9(15)16/h2H,1H3,(H,13,14)(H,15,16)
InChIKey GNOGSFBXBWBTIG-UHFFFAOYSA-N
SmilesC(O)(=O)C1=C(I)C=C(I)C(NC(C)=O)=C1I
MS
1HNMR
13CNMR
IR1
IR2
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