p-Butylbenzoic acid p-methoxyphenyl ester(35684-23-2) IR1

Product Namep-Butylbenzoic acid p-methoxyphenyl ester

CAS 35684-23-2

Molecular FormulaC18H20O3

Molecular Weight284.35

InChIInChI=1S/C18H20O3/c1-3-4-5-14-6-8-15(9-7-14)18(19)21-17-12-10-16(20-2)11-13-17/h6-13H,3-5H2,1-2H3

InChIKey BISLKTRYMAGJLH-UHFFFAOYSA-N

SmilesC(OC1=CC=C(OC)C=C1)(=O)C1=CC=C(CCCC)C=C1

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    Assign.     Shift(ppm)

      A             8.09
      B             7.30
      C             7.11
      D             6.94
      E             3.807
      F             2.69
      G             1.64
      J             1.36
      K             0.95

Spectral Code: 1H NMR : 90 MHz in CDCl3

       ppm   Int.  Assign.

      165.74   121      1
      157.47   280      2
      149.34   247      3
      144.76   275      4
      130.37   813      5
      128.79   775      6
      127.33   319      7
      122.66   929      8
      114.69  1000      9
       55.72   423     10
       35.93   374     11
       33.42   357     12
       22.46   308     13
       14.03   286     14

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : KBr disc

Spectral Code: Raman : 4880 A,200 M,powder

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