Product Name2,4,6-TRIBROMOPHENYLDECANOATE

CAS

Molecular FormulaC16H21Br3O2

Molecular Weight485.04874

InChIInChI=1S/C16H21Br3O2/c17-12-10-14(18)13(15(19)11-12)8-6-4-2-1-3-5-7-9-16(20)21/h10-11H,1-9H2,(H,20,21)

InChIKey SHSTUZRYHZNMDD-UHFFFAOYSA-N

SmilesC(O)(=O)CCCCCCCCCC1=C(Br)C=C(Br)C=C1Br

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¹HNMR

¹³CNMR

IR1

    Assign.     Shift(ppm)

      A             7.697
      B             2.64
      C             1.81
      D             1.47
      E             1.29
      F             0.90

Spectral Code: 1H NMR : 90 MHz in CDCl3

       ppm   Int.  Assign.

      169.65   468      1
      145.82   241      2
      134.77  1000      3
      119.64   409      4
      118.52   768      5
       33.86   405      6
       31.87   450      7
       29.41   527      8
       29.24   809      9
       29.12   550     10
       24.72   441     11
       22.68   455     12
       14.11   382     13

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : nujol mull

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