Skip to main content

How would you identify various functional groups by IR spectroscopy provide supporting examples.

 

Clinical courses

 

Clinical courses

Q.2. (b)How would you identify various functional groups by IR spectroscopy provide supporting examples.

Ans.2. (b)Identify various functional groups by IR spectroscopy:

When identify various functional groups by IR spectroscopy analysing the spectrum of an unknown, concentrate your first efforts on determining the presence of (or absence) of a few major functional groups. The C = O, O – H, N – H, C – O, C = C, C= C, C=_N, and NO2 peaks are the most conspicuous and give immediate structural information if they are present. Do not try to make a detailed analysis of the C – H, absorption near 3000cm-1, almost all compounds have these absorptions. Do not worry about subtleties of the exact environment in which the functional group is found. Following is a major checklist of the important gross features.

1. Is a carbonyl group present? The C = O group gives rise to a strong absorption in the region 1820 – 1660 cm-1. The peak is often the strongest in the spectrum and of medium width. You can’t miss it.

2.  If C = O is present, check the following types
(If it is absent, go to step 3):

ACIDS

Is O – H also present?

Broad absorption near 3400-2400cm-1 (Usually overlaps C - H).

AMIDES

Is N – H also present?

Medium absorption near 3400cm-1, sometimes a double peak with equivalent halves.

ESTERS

Is C – O also present?

Strong-intensity absorption near 1300-1000cm-1.

ANHYDRIDES

Two C = O absorptions near 1810 and 1760cm-1.

ALDEHYDES

Is aldehyde C – H present?

Two weak absorption near 2850 and 2750cm-1on right side of the aliphatic C – H absorptions.

KETONES

The preceding five choices have been eliminated.

3. If C = O is absent:

ALCOHOLS,PHENOLS

Check for O – H.

Broad absorption near 3400-3300cm-1.

Confirm this by finding C – O near 1300-1000cm-1.

AMINES

Check for N – H.

Medium absorptions near 3400cm-1.

ETHERS

Check for C- O near 1300-1000cm-1(and absence of O – H near 3400cm-1).

4.    Double bonds and/or aromatic rings.
C = C is a weak absorption near 1650 cm.
Medium to strong absorption in the region 1600-1450cm-1, these often imply an aromatic ring.
Confirm  the double bond or aromatic ring by consulting the C – H region; aromatic and vinyl C – H occur to the left of 3000cm-1 (Aliphatic C – H occurs to the right ofthis value).

5.    Triple bonds.
C ≡ N is a medium, sharp absorption near 2250cm-1.
C ≡ C is a weak, sharp absorption near 2150cm-1.
Check also for acetylenic C – H near 3300-1.

6.    Nitro groups.
Two strong absorptions at 1600-1530cm-1,and 1390-1300cm-1

7.    Hydrocarbons.
None of the preceding is found.
Major absorptions are in C – H region near 3000cm-1.
Very simple spectrum, the only other absorption appears near 1460 and 1375 cm-1.

JOIN PHARMATUTOR TEST SERIES

Subscribe to Pharmatutor Job Alerts by Email