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612-78-2

2,2'-联二萘(612-78-2)ESR图谱

产品名称:2,2'-联二萘

CAS:612-78-2

分子式:C20H14

分子量: 254.33

InChI:InChI=1S/C20H14/c1-3-7-17-13-19(11-9-15(17)5-1)20-12-10-16-6-2-4-8-18(16)14-20/h1-14H

InChIKey: MSBVBOUOMVTWKE-UHFFFAOYSA-N

Smiles:C1=C2C(C=CC=C2)=CC=C1C1=CC=C2C(=C1)C=CC=C2

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        Assign.     Shift(ppm)
    A 8.172 B 7.96 C *1 7.94 D *1 7.89 E 7.89 F *2 7.53 G *2 7.50
    Spectral Code: 1H NMR : 400 MHz in CDCl3

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           ppm   Int.  Assign.
    138.68 503 1 134.03 411 2 132.95 429 3 128.59 865 4 128.35 847 5 * 127.78 926 6 * 126.41 969 7 # 126.24 1000 8 126.06 945 9 # 125.84 896 10 ASSIGNED BY C-H COSY.
    Spectral Code: 13C NMR : in CDCl3

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    Spectral Code: IR : KBr disc

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    Spectral Code: ESR : ANION RADICAL, REDUCTION WITH K IN THF

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