Product NameTRANS-(2-DOCOSENYL)SUCCINICACID

CAS

Molecular FormulaC26H48O4

Molecular Weight424.65692

InChIInChI=1S/C26H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(26(29)30)23-25(27)28/h20-21,24H,2-19,22-23H2,1H3,(H,27,28)(H,29,30)/b21-20+

InChIKey PCWQYXHXPWMHGK-QZQOTICOSA-N

SmilesC(O)(=O)C(C/C=C/CCCCCCCCCCCCCCCCCCC)CC(O)=O

Request For Quotation

¹HNMR

¹³CNMR

IR1

    Assign.     Shift(ppm)

      A            11.
      B     *1      5.515
      C     *1      5.314
      D             2.889
      E     *2      2.679
      F     *2      2.522
      G     *3      2.444
      J     *3      2.230
      K             1.99
      L          1.33 to 1.28
      M             1.25
      N             0.879
     
     ASSIGNED BY COSY.
     J(D,E) = 10.4 HZ.
     J(D,F) = 3.7 HZ.
     J(E,F) = -17.4 HZ.

Spectral Code: 1H NMR : 400 MHz in CDCl3

       ppm   Int.  Assign.

      180.74    41      1
      178.51    47      2
      134.93    56      3
      125.06    63      4
       41.23    53      5
       34.59    38      6
                        7
       32.51    66      8
       31.94   124      9
       29.86    64     10 *
       29.72  1000     11 *
       29.58    93     12 *
       29.52    96     13 *
       29.46    55     14 *
       29.37   188     15 *
                       16 *
       29.20    77     17
       22.70   117     18
       14.10   115     19

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : nujol mull

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