Chemistry 9701 · AS & A Level · Analytical techniques

Analytical techniques — practice question

Compound F is made up only of carbon, hydrogen and oxygen. Every carbon-carbon bond in F is a single bond. The structure of F was studied by mass spectrometry, infra-red spectroscopy and NMR spectroscopy.
(a(i))[2]

The mass spectrum shows that the $m/e$ value for the M peak is $90$. The heights of the M and M+1 peaks are in the ratio $22.1 : 0.7$. Use the M and M+1 peak-height ratio to calculate how many carbon atoms are in a molecule of F.

(a(ii))[1]

Suggest the molecular formula for F.

(b)[2]

The infra-red spectrum of F was obtained. Use the Data Booklet and your knowledge of infra-red spectroscopy to identify the bond type and the functional group responsible for these three absorptions at $3350\ \text{cm}^{-1}$, $2680\ \text{cm}^{-1}$ and $1725\ \text{cm}^{-1}$.

(a)

The mass spectrum shows that the $m/e$ value for the M peak is 90. The heights of the M and M+1 peaks are in the ratio $22.1 : 0.7$.

(c)

F was dissolved in deuterated trichloromethane, $\text{CDCl}_3$, and the proton NMR spectrum of this solution was obtained.

(c(i))[4]

Use the Data Booklet together with your answer to part (a)(ii) to complete Table 1 for the proton NMR spectrum of F. The four absorptions in F have been given with their actual chemical shifts at $\delta = 1.4$, $3.9$, $4.7$ and $12.9\,\text{ppm}$.

(c(ii))[1]

Describe and explain the splitting pattern shown by the absorption at $\delta = 1.4$.

(c(iii))[1]

F was dissolved in $\text{D}_2\text{O}$ and the proton NMR spectrum of this new solution was obtained. Which two absorptions in Table 1 were absent from this spectrum?

(c(iv))[1]

Suggest the structure of F.

(d)

Molecules of cycloheptadiene, $\text{C}_7\text{H}_{10}$, have a seven-membered ring containing two carbon-carbon double bonds.

(d(i))[1]

Complete the skeletal formulae for two isomers of cycloheptadiene.

(d(ii))[2]

Predict the number of peaks that will be seen in the carbon-13 NMR spectra of P and Q.

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