(a) To detect the drug ibuprofen by liquid chromatography– mass spectrometry, would you choose the positive or negative ion mode for the spectrometer? Would you choose acidic or neutral chromatography solvent? State your reasons.

(b)If the unfragmented ion has an intensity of 100, what should be the intensity of M+1?

Short Answer

Expert verified

The condensed structural formula in the figure above , the molecular formula of ibuprofen is deduced to be C13H17O2-. Using the values from table 21-2 , we calculate the intensity of the M+1 peak.

Step by step solution

01

 Ibuprofen

Ibuprofen is a medication in the nonsteroidal anti-inflammatory drug class that is used for treating pain, fever, and inflammation. This includes painful menstrual periods, migraines, and rheumatoid arthritis. It may also be used to close a patent ductus arteriosus in a premature baby.

02

 Answering the above mentioned question

For the analysis of ibuprofen, it is best to use the negative ion mode of the spectrometer

Give its structure , the hydrogen in the carboxylic acid side chain is the most likely to dissociate , creating a CO2 anlon . A neutral is also best to be used , as to not protonate CO2-

TO solve for the M =1 peak intensity of an unfragmented ion having an intensity of 100 , we first deduce ibuprofen ‘s molecular formula by creating a condensed structural formula based on the structure given:

Given the condensed structural formula in the figure above , the molecular formula of ibuprofen is deduced to be C13H17O2-. Using the values from table 21-2 , we calculate the intensity of the M+1 peak.

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Most popular questions from this chapter

31: Which liquid chromatography/mass spectrometry interface, atmospheric pressure chemical ionization or electrospray, requires analyte ions to be in solution prior to the interface? How does the other interface create gaseous ions from neutral species in solution?

(a) Explain the purpose of the dynamic reaction cell in Figure 21-30. (b) In geologic strontium isotopic analysis, there is isobaric interferencebetween 87Rb+and 87Sr+A dynamic reaction cell with CH3Fconverts Sr+to SrF+but does not convert Rb+to RbF+How does this reaction eliminate interference?

The molecular ion region in the mass spectrum of a large molecule, such as a protein, consists of a cluster of peaks differing by 1 Da. This pattern occurs because a molecule with many atoms has a high probability of containing one or several atoms of C1315N,18O,2Hand 32S. In fact, the probability of finding a molecule with only C1214N,16O,1Hand 32S may be so small that the nominal molecular ion is not observed. The electrospray mass spectrum of the rat protein interleukin-8 consists of a series of clusters of peaks arising from intact molecular ions with different charge. One cluster has peaks at m/z 1 961.12, 1 961.35, 1 961.63, 1 961.88, 1 962.12 (tallest peak), 1 962.36, 1 962.60, 1 962.87, 1 963.10, 1 963.34, 1 963.59, 1 963.85, and 1 964.09. These peaks correspond to isotopic ions differing by 1 Da. From the observed peak separation, fi nd the charge of the ions in this cluster. From m/z of the tallest peak, estimate the molecular mass of the protein.

33:Why does vacuum ultraviolet photoionization with |120-nmwavelength radiation produce less molecular fragmentation than

does 70 eV electron ionization?

Chlorate (CIO-3), chlorite (CIO-2), bromate (BrO-3), and iodate (IO-3)can be measured in drinking water at the 1-ppb level with 1% precision by selected reaction monitoring. Chlorate and chlorite arise from CIO2used as a disinfectant. Bromate and iodate can be formed from Br-or I-when water is disinfected with ozone O3. For the highly selective measurement of chlorate, the negative ion selected by Q1 in Figure 22-33 is m/z 83 and the negative ion selected by Q3 is m/z 67. Explain how this measurement works and how it distinguishes CIO3-from CIO2-, BrO3-, andIO3-

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