(9Z,12Z)-octadeca-9,12-dienoic acid - (2E)-but-2-enedioic acid (1:1)结构式

(9Z,12Z)-octadeca-9,12-dienoic acid - (2E)-but-2-enedioic acid (1:1)
英文名称:(9Z,12Z)-octadeca-9,12-dienoic acid - (2E)-but-2-enedioic acid (1:1)
CAS No.:68037-30-9
分子式:C18H32O2.C4H4O4 分子量:396.51764
(9Z,12Z)-octadeca-9,12-dienoic acid - (2E)-but-2-enedioic acid (1:1) 数据
Mol:
0  0  0  0  0
   14.9563    1.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3159    2.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3159    3.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6756    4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6756    6.2800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0352    7.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0352    8.6350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3949    9.4200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.3550    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  1  7  2  0  0  0  0
  1  8  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
  9 27  2  0  0  0  0
  9 28  1  0  0  0  0
M  END                                
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(9Z,12Z)-octadeca-9,12-dienoic acid - (2E)-but-2-enedioic acid (1:1) Smile 编码:
C(O)(=O)/C=C/C(O)=O.C(O)(=O)CCCCCCC/C=C/C/C=C/CCCCC