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返回ChemicalBook首页>CAS数据库列表>14103-61-8更多图谱> 邻苯二甲酸二(3,5,5-三甲基己基)酯(14103-61-8)核磁图(13CNMR)

14103-61-8

邻苯二甲酸二(3,5,5-三甲基己基)酯(14103-61-8)核磁图(13CNMR)

分子式:C26H42O4

分子量: 418.61

InChI:InChI=1S/C26H42O4/c1-19(17-25(3,4)5)13-15-29-23(27)21-11-9-10-12-22(21)24(28)30-16-14-20(2)18-26(6,7)8/h9-12,19-20H,13-18H2,1-8H3

InChIKey: GDJOUZYAIHWDCA-UHFFFAOYSA-N

Smiles:C1(C(OCCC(C)CC(C)(C)C)=O)=CC=CC=C1C(OCCC(C)CC(C)(C)C)=O

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        Assign.     Shift(ppm)
    A 7.69 B 7.53 C 4.33 D 1.94 to 1.40 E *1 1.24 F *1 1.09 G 0.99 J 0.90
    Spectral Code: 1H NMR : 90 MHz in CDCl3

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           ppm   Int.  Assign.
    167.47 376 1 132.49 418 2 130.78 499 3 128.78 569 4 64.21 581 5 51.16 604 6 37.79 468 7 31.05 343 8 30.00 1000 9 26.44 371 10 22.59 490 11
    Spectral Code: 13C NMR : in CDCl3

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    Spectral Code: IR : liquid film

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