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616-72-8

4,6-DINITRO-1,3-XYLENE(616-72-8)红外图谱(IR1)

产品名称:4,6-DINITRO-1,3-XYLENE

CAS:616-72-8

分子式:C8H8N2O4

分子量: 196.16

InChI:InChI=1S/C8H8N2O4/c1-5-3-6(2)8(10(13)14)4-7(5)9(11)12/h3-4H,1-2H3

InChIKey: FOWXIRIJHSFCRC-UHFFFAOYSA-N

Smiles:C1(C)=CC(C)=C([N+]([O-])=O)C=C1[N+]([O-])=O

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        Assign.     Shift(ppm)
    A 8.69 B 7.39 C 2.69
    Spectral Code: 1H NMR : 90 MHz in CDCl3

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           ppm   Int.  Assign.
    146.81 191 1 139.09 985 2 137.43 719 3 121.75 553 4 20.57 1000 5
    Spectral Code: 13C NMR : in CDCl3

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    Spectral Code: IR : KBr disc

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    Spectral Code: Raman : 4880 A,200 M,powder

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