Product Name2-Acetyl-5-nitro-2H-indazole
Molecular FormulaC9H7N3O3
Molecular Weight205.17018
InChIInChI=1S/C9H7N3O3/c1-6(13)11-5-7-4-8(12(14)15)2-3-9(7)10-11/h2-5H,1H3
InChIKey ORIGJAVPNXBIBN-UHFFFAOYSA-N
SmilesN1=C2C(C=C([N+]([O-])=O)C=C2)=CN1C(C)=O
Parameter ppm Hz
D(A) 9.05 D(B) 8.75 D(C) 8.15 D(D) 7.80 J(A,B) 0.0 J(A,C) 0.0 J(A,D) 1.0 J(B,C) 2.0 J(B,D) 1.0 J(C,D) 9.5 D(E) 2.95 ELGUERO,J. ET AL. BULL.SOC.CHIM.FR. 1966, 2075
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