2,1-Benzisoxazole,5-nitro-(7CI,8CI,9CI)(4104-36-3) ¹H NMR

Product Name2,1-Benzisoxazole,5-nitro-(7CI,8CI,9CI)

CAS 4104-36-3

Molecular FormulaC7H4N2O3

Molecular Weight

InChIInChI=1S/C7H4N2O3/c10-9(11)6-1-2-7-5(3-6)4-12-8-7/h1-4H

InChIKey AFBFYMLZIWNGPH-UHFFFAOYSA-N

SmilesN1=C2C(C=C([N+]([O-])=O)C=C2)=CO1

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¹HNMR

    Parameter     ppm  Hz

      D(A)        10.03
      D(B)         8.90
      D(C)         8.12
      D(D)         7.83
       J(A,B)          0.0
       J(A,C)          0.0
       J(A,D)          1.0
       J(B,C)          1.9
       J(B,D)          1.3
       J(C,D)         10.8
     
     ALTAF-UR-RAHMAN & BOULTON,A.J. TETRAHEDRON,SUPPL. 7, 49 (1966)

Spectral Code: 1H NMR : parameter in acetone

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2,1-Benzisoxazole,5-nitro-(7CI,8CI,9CI)(4104-36-3) 1H NMR

2,1-Benzisoxazole,5-nitro-(7CI,8CI,9CI)(4104-36-3) ¹H NMR