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Back ChemicalBook Home>CAS DataBase List>18641-57-1More Spectrum> TRIBEHENIN(18641-57-1) IR2

18641-57-1

TRIBEHENIN(18641-57-1) IR2

Product NameTRIBEHENIN

CAS18641-57-1

Molecular FormulaC69H134O6

Molecular Weight1059.8

InChIInChI=1S/C69H134O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h66H,4-65H2,1-3H3

InChIKey DMBUODUULYCPAK-UHFFFAOYSA-N

SmilesC(OC(=O)CCCCCCCCCCCCCCCCCCCCC)C(OC(=O)CCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCC

400 MHz in CDCl3

  • TRIBEHENIN(18641-57-1) IR2

    1H NMR 399.65 MHz
    C69 H134 O6 0.029 g : 0.5 ml CDCl3
    1,2,3-propanetriyl tridocosanoate
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             5.255
      B     *1      4.290
      C     *1      4.145
      D             2.302
      E             1.60
      F             1.29
      G             1.26
      J             0.879
  

         Hz     ppm     Int.


        927.00   2.320     24
    921.75   2.307     26
    919.68   2.302     41
    911.99   2.282     28
    527.83   1.321     20
    513.31   1.285     77
    503.17   1.260   1000
    490.36   1.227     30
    358.52   0.898     35
    351.81   0.881    121
    344.85   0.863     44

in CDCl3

  • TRIBEHENIN(18641-57-1) IR2

KBr disc

  • TRIBEHENIN(18641-57-1) IR2

nujol mull

  • TRIBEHENIN(18641-57-1) IR2

TRIBEHENIN(18641-57-1) IR2 Atlas of Related Products

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