Question

The 1H NMR, 13C NMR, mass and IR spectra of compound with a molecular formula (C9H11NO2) are given below.

I need help identifying a compound based on the spectra. The compound contains an aromatic ring. The spectra are attached. I would appreciate an accurate description.

The 1H NMR, 13C NMR, mass and IR spectra of compound with a molecular formula (C9H11NO2) are given below. Use the given spectroscopic data to provide rational interpretation (motivation) of all the spectral data to determine the structure of this compound.

spectrum.png

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Answer #1
  • in the IR spectrum, the value around 3400 CM-1 and 1640 CM-1 indicates there is NH2 and ester group respectively.
  • the odd mass indicates the odd number of nitrogen present in the given molecule.
  • the 1H NMR indicates that the molecule is symmetrically substituted. there are two doublet at the aromatic region, one quartet at 4.2 ppm for -OCH2 group because of -CH3 group. and one triplet for -CH3 group because of -CH2 proton.
  • 13C indicates there are 7 signals in the 13C spectrum.
  • So based on the given data the unknown molecule is given above.
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