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Back ChemicalBook Home>CAS DataBase List>91165-64-9More Spectrum> 1,1'-(Naphthalene-1,8-diyl)bis[1H-1,2,3-triazole-4,5-dicarboxylic acid di(1,1-dimethylethyl)] ester(91165-64-9) IR1

1,1'-(Naphthalene-1,8-diyl)bis[1H-1,2,3-triazole-4,5-dicarboxylic acid di(1,1-dimethylethyl)] ester(91165-64-9) IR1

Molecular Formula

Molecular Weight

InChIInChI=1S/C26H26N6O8/c1-25(2,3)39-23(37)18-20(24(38)40-26(4,5)6)32(30-28-18)15-12-8-10-13-9-7-11-14(16(13)15)31-19(22(35)36)17(21(33)34)27-29-31/h7-12H,1-6H3,(H,33,34)(H,35,36)

InChIKey UCJRKNVTJTWPTM-UHFFFAOYSA-N

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


  • Mass

    MS-NW-7321          
    1,1'-(1,8-naphthylene)bis(1H-1,2,3-triazole-4,5-dicarboxylic acid) tetra-tert-butyl ester
    C34H42N6O8          (Mass of molecular ion:    662)
    

       Source Temperature: 190 °C
       Sample Temperature: 180 °C
       Direct, 75 eV
    

          16.0       1.5
          18.0       1.6
          26.0       2.8
          27.0      11.6
          28.0      14.0
          29.0       9.2
          37.0       3.1
          38.0       5.3
          39.0      38.4
          40.0       9.0
          41.0     100.0
          42.0       3.6
          44.0      70.4
          49.0       2.1
          50.0       6.5
          51.0       5.5
          52.0       1.4
          53.0       5.8
          54.0       2.4
          55.0      19.7
          56.0      49.2
          57.0      16.0
          63.0       2.1
          69.5       1.8
          74.0       1.1
          75.0       1.6
          76.0       1.7
          77.0       1.0
          87.0       1.0
          89.0       1.3
         113.0       1.4
         125.0       1.1
         126.0       1.7
         127.0       2.8
         138.0       1.2
         139.0       3.9
         140.0       3.2
         151.0       1.6
         152.0       3.7
         153.0       3.7
         164.0       2.1
         165.0       1.4
         166.0       3.6
         167.0       1.0
         178.0       2.5
         179.0       1.6
         180.0       1.3
         203.0       1.1
         204.0       2.0
         205.0      17.8
         206.0       8.4
         207.0       1.6
         208.0       1.1
         232.0       2.0
         249.0       1.1
         250.0       2.8
         252.0       1.2
         262.0       5.4
         263.0       1.1
         276.0       2.5
         294.0       1.4
         366.0       1.2
    

KBr disc



1,1'-(Naphthalene-1,8-diyl)bis[1H-1,2,3-triazole-4,5-dicarboxylic acid di(1,1-dimethylethyl)] ester(91165-64-9) IR1 Atlas of Related Products

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