Mass spectrometry Flashcards

1
Q

what happens when an organic compound is placed into a mass spectrometer?

A

it loses an electron and forms a positive ion, molecular ion. The mass spectrometer detects the mass to charge ratio (m/z) of the molecular ion which gives the molecular mass

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2
Q

how do you find the molecular mass from a mass spectrum?

A

the molecular ion peak (M+ peak) must be located. It is the clear peak at the highest m/z value on the right of the mass spectrum.

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3
Q

what is the peak next to the molecular ion peak?

A

It is referred as the M+1 peak. It exists due to 1.1 percent of carbon present as carbon-13 isotope

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4
Q

what is fragmentation?

A

in the mass spectrometer, some molecular ions break down into fragments. Other peaks are caused by fragment ions.

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5
Q

What does the simplest fragmentation form? and how does it affect the mass spectrum?

A

two species formed- positively charged fragment ion and a radical. Any positive ion formed will be detected not uncharges radicals.

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6
Q

why do all molecules fragment differently?

A

depending on their structures. So this allows us to identify molecules

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7
Q

what are the main features of a mass spectrum?

A
  • molecular ion peak
  • M+1 peak
  • a number of fragment ion peaks
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8
Q

what happens when covalent bonds absorb infrared radiation?

A

they bend or stretch more

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9
Q

what happens when covalent bonds absorb infrared radiation?

A

they bend or stretch more. Stretch meaning rhythmic movement along line between atoms so distance between two atomic centres increases and decreases. A bend results in a change in bond angle.

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10
Q

what does the amount that a bond stretches or bend depend on?

A
  • the mass of the atoms in bond. Heavier atoms vibrate more slowly.
  • the strength of the bond. Stronger bonds vibrate faster.
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11
Q

Since frequency values are very large, chemists use what more convenient scale?

A

wavenumber which is proportional to frequency.

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12
Q

Describe the wavelength of radiation which is re-emitted from earth’s surface?

A

longer wavelength

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13
Q

What absorb these longer wavelength radiation?

A

greenhouse gases e.g carbon dioxide, water vapour, methane as it has the same frequency as the natural frequency of their bonds. Vibrating bonds in these molecules re-emit energy as radiation to the Earth, increasing temp-global warming

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14
Q

Chemists use infrared spectroscopy to identify functional groups in organic molecules. How does this work?

A
  • sample placed in IR spectrometer
  • beam of radiation (200-4000cm-1) is passed through sample
  • molecule absorbs some IR radiation. Emerging beam of radiation is analysed to identify frequencies that have been absorbed by the sample
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15
Q

what are the number of peaks called in an infrared spectrum?

A

fingerprint region. Unique peaks are used to identify molecules

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16
Q

where is the peak of the C-H bond?

A

2850-3100cm-1

17
Q

Describe the infrared spectrum of an alcohol?

A

broad peak within 3200-3600cm-1 caused by O-H bond. There is also a peak between 1000-1300cm-1 caused by C-O bond.

18
Q

Describe the infrared spectrum of an alcohol?

A

broad peak within 3200-3600cm-1 caused by O-H bond in alcohol. There is also a peak between 1000-1300cm-1 caused by C-O bond.

19
Q

Describe the infrared spectrum of an aldehyde/ketone

A

has a key absorbance peak between 1630-1820cm-1 caused by C=O bond.

20
Q

Describe the infrared spectrum of a carboxylic acid

A

key absorbance peak between 1630-1820cm-1 caused by C=O bond. A very broad peak between 2500-3330cm-1caused by O-H bond in carboxylic acid. Peak at 1000-1300cm-1 for the C-O bond which is nor always reliable as it is in the fingerprint region.

21
Q

describe applications of infrared spectroscopy

A
  • remote sensors analyse IR spectral fingerprints of vehicle emissions e.g carbon dioxide, carbon monoxide to monitor local pollution.
  • IR-based breathalysers can detect ethanol in the breath
22
Q

what is the typical sequence of identification of compounds?

A
  • elemental analysis
  • mass spectrometry
  • infrared spectroscopy
23
Q

what is elemental analysis?

A

use of percentage composition data to determine the empirical formula

24
Q

what is mass spectroscopy?

A

use of the molecular ion peak from a mass spectrum to determine the molecular mass; use of fragment ions to identify sections of a molecule

25
Q

what is mass spectroscopy?

A

use of absorption peaks from an infrared spectrum to identify bonds and functional groups present in the molecule