2t-Hexadecenoic acid(929-79-3) ¹H NMR

Product Name2t-Hexadecenoic acid

CAS 929-79-3

Molecular FormulaC16H30O2

Molecular Weight254.41

InChIInChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h14-15H,2-13H2,1H3,(H,17,18)/b15-14+

InChIKey ZVRMGCSSSYZGSM-CCEZHUSRSA-N

SmilesC(O)(=O)/C=C/CCCCCCCCCCCCC

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¹HNMR

¹³CNMR

IR1

    Assign.     Shift(ppm)

      A            11.
      B             7.10
      C             5.82
      D             2.23
      E             1.46
      F             1.26
      G             0.88
     
     J(B,C)=15.7HZ. J(B,D)=6.9HZ.

Spectral Code: 1H NMR : 90 MHz in CDCl3

       ppm   Int.  Assign.

      172.41   439      1
      152.45   312      2
      120.74   249      3
       32.37   222      4
       31.99   308      5
       29.72  1000      6
       29.60   425      7
       29.43   561      8
       29.21   281      9
       27.96   231     10
       22.74   267     11
       14.14   235     12

Spectral Code: 13C NMR : in CDCl3

Spectral Code: IR : KBr disc

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2t-Hexadecenoic acid(929-79-3) 1H NMR

2t-Hexadecenoic acid(929-79-3) ¹H NMR