MYRISTIC ACID 2-CHLOROETHYL ESTER(51479-36-8) IR1

Product NameMYRISTIC ACID 2-CHLOROETHYL ESTER

CAS 51479-36-8

Molecular FormulaC16H31ClO2

Molecular Weight290.87

InChIInChI=1S/C16H31ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16(18)19-15-14-17/h2-15H2,1H3

InChIKey MPNMNLLETRXDEX-UHFFFAOYSA-N

SmilesC(OCCCl)(=O)CCCCCCCCCCCCC

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¹HNMR

¹³CNMR

IR1

    Assign.     Shift(ppm)

      A             4.328
      B             3.680
      C             2.350
      D             1.637
      E          1.34 to 1.290
      F             1.26
      G             0.880

Spectral Code: 1H NMR : 400 MHz in CDCl3

       ppm   Int.  Assign.

      173.45   244      1
       63.85   323      2
       41.63   373      3
       34.14   313      4
       31.99   368      5
       29.71  1000      6 *
                        7 *
                        8 *
                        9 *
       29.51   408     10 *
       29.42   398     11 *
       29.30   348     12 *
       29.16   358     13 *
       24.96   353     14
       22.74   358     15
       14.13   259     16

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : liquid film

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