2,1-Benzisoxazole,7-nitro-(7CI,8CI,9CI)(4104-37-4) ¹H NMR

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

CAS 4104-37-4

Molecular FormulaC7H4N2O3

Molecular Weight

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

InChIKey LYLXGHYESWVBPQ-UHFFFAOYSA-N

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

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¹HNMR

    Parameter     ppm  Hz

      D(A)        10.06
      D(B)         8.38
      D(C)         7.40
      D(D)         8.56
       J(A,B)          0.0
       J(A,C)          0.0
       J(A,D)          0.0
       J(B,C)          9.0
       J(B,D)          1.0
       J(C,D)          7.6
     
     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,7-nitro-(7CI,8CI,9CI)(4104-37-4) 1H NMR

2,1-Benzisoxazole,7-nitro-(7CI,8CI,9CI)(4104-37-4) ¹H NMR