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Back ChemicalBook Home>CAS DataBase List>17110-51-9More Spectrum> Cholesteryl oleyl carbonate(17110-51-9) IR2

Cholesteryl oleyl carbonate(17110-51-9) IR2

Product NameCholesteryl oleyl carbonate

CAS17110-51-9

Molecular FormulaC46H80O3

Molecular Weight681.13

InChIInChI=1/C46H80O3/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-34-48-44(47)49-39-30-32-45(5)38(35-39)26-27-40-42-29-28-41(37(4)25-23-24-36(2)3)46(42,6)33-31-43(40)45/h14-15,26,36-37,39-43H,7-13,16-25,27-35H2,1-6H3/b15-14-/t37-,39+,40+,41-,42+,43+,45+,46-/s3

InChIKey XMPIMLRYNVGZIA-LDPLKVIWNA-N

Smiles[C@]12([H])CC[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])CC=C1C[C@@H](OC(=O)OCCCCCCCC/C=C\CCCCCCCC)CC[C@]21C)[C@H](C)CCCC(C)C |&1:0,4,6,9,11,17,42,44,r|

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1HNMR

13CNMR

IR1

IR2

Raman 



  •     Assign.     Shift(ppm)
    
      A             5.39
      B             5.34
      C             4.470
      D             4.107
      E             2.41
      F             2.01
      G             1.27
      L             1.009
      M             0.914
      N             0.88
      P     *1      0.866
      Q     *1      0.862
      R             0.677
    Spectral Code: 1H NMR : 400 MHz in CDCl3









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