1,1'-(Naphthalene-1,8-diyl)bis(1H-1,2,3-triazole-4,5-dicarboxylic acid diethyl) ester(91165-62-7) ¹³C NMR

Product Name1,1'-(Naphthalene-1,8-diyl)bis(1H-1,2,3-triazole-4,5-dicarboxylic acid diethyl) ester

Molecular FormulaC26H26N6O8

Molecular Weight550.52

InChIInChI=1S/C26H26N6O8/c1-5-37-23(33)19-21(25(35)39-7-3)31(29-27-19)16-13-9-11-15-12-10-14-17(18(15)16)32-22(26(36)40-8-4)20(28-30-32)24(34)38-6-2/h9-14H,5-8H2,1-4H3

InChIKey HJVVMCWGYRNCKI-UHFFFAOYSA-N

SmilesC1(N2C(C(OCC)=O)=C(C(OCC)=O)N=N2)=C2C(C=CC=C2N2C(C(OCC)=O)=C(C(OCC)=O)N=N2)=CC=C1

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¹HNMR

¹³CNMR

IR1

    Assign.     Shift(ppm)

      A             8.251
      B             7.709
      C             7.462
      D     *1      4.46
      E     *1      4.45
      F             4.191
      G             1.445
      J             1.082
     
     J(A,B)=8.4HZ. J(B,C)=7.3HZ. J(F,J)=7.0HZ. J(D,G)=J(E,G)=7.2HZ.

Spectral Code: 1H NMR : 400 MHz in CDCl3

       ppm   Int.  Assign.

      159.79   147      1
      156.90   107      2
      140.28    64      3
      135.27   182      4
      132.42   760      5
      131.77    71      6
      130.45   202      7
      129.94   491      8
      125.98   895      9
      124.91    64     10
       62.49  1000     11
       61.88   798     12
       14.18   964     13
       13.52   756     14

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : KBr disc

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1,1'-(Naphthalene-1,8-diyl)bis(1H-1,2,3-triazole-4,5-dicarboxylic acid diethyl) ester(91165-62-7) 13C NMR

1,1'-(Naphthalene-1,8-diyl)bis(1H-1,2,3-triazole-4,5-dicarboxylic acid diethyl) ester(91165-62-7) ¹³C NMR