2082-80-6

Phosphorous acid tri-n-octadecyl ester(2082-80-6) IR1

Product NamePhosphorous acid tri-n-octadecyl ester

CAS 2082-80-6

Molecular FormulaC54H111O3P

Molecular Weight839.43

InChIInChI=1S/C54H111O3P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58(56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h4-54H2,1-3H3

InChIKey CNUJLMSKURPSHE-UHFFFAOYSA-N

SmilesP(OCCCCCCCCCCCCCCCCCC)(OCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC

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¹HNMR

¹³CNMR

IR1

Phosphorous acid tri-n-octadecyl ester(2082-80-6) IR1

    Assign.     Shift(ppm)

      A             3.637
      B             1.565
      C             1.31
      D             1.26
      E             0.879

Spectral Code: 1H NMR : 400 MHz in CDCl3

Phosphorous acid tri-n-octadecyl ester(2082-80-6) IR1

       ppm   Int.  Assign.

       63.06   217      1
       32.73   219      2
       31.96   204      3
       29.74  1000      4 *
       29.71   481      5 *
                        6 *
                        7 *
       29.65   347      8 *
                        9 *
       29.48   221     10 *
       29.40   225     11 *
       25.77   189     12
       22.72   225     13
       14.13   196     14

Spectral Code: 13C NMR : in CDCl3