ortho- meta- - university of missouri–st. louisorglab/pdffiles/irspec2.pdffigure 11. ortho-xylene,...
TRANSCRIPT
Table of Spectra
Figure 5. NujolFigure 6. N-DecaneFigure 7. BenzeneFigure 8. IndeneFigure 9. 1-Heptene
Figure 10. trans -4-Octene
Figure 11. ortho-XyleneFigure 12. meta-XyleneFigure 13. PhenylacetyleneFigure 14. ButanalFigure 15. BenzaldehydeFigure 16. ChloroformFigure 17. Tri-t-butylmethanolFigure 18. ButylamineFigure 19. BenzamideFigure 20. DiethylamineFigure 21. N-Methyl acetamideFigure 22. TriethylamineFigure 23. N,N-Dimethyl acetamideFigure 24. n-Hexanol, vapor and liquidFigure 25. Phenol, vapor and liquidFigure 26. Hexanoic acid, vapor and liquidFigure 27. Decanoic acidFigure 28. 4-Chloro-2-nitrophenolFigure 29. Benzoic acidFigure 30. Benzoic acidFigure 31. trans-2-Phenyl-1-cyanoetheneFigure 32. Diethyl acetylenedicarboxylateFigure 33. Methyl acetateFigure 34. Ethyl n-hexanoate, vapor and liquidFigure 35. 5-Hexene-2-oneFigure 36. Propionic anhydrideFigure 37. Benzoic anhydrideFigure 38. 3-Methylpimelic acid anhydrideFigure 39. 2,5-DihydrofuranFigure 40. 2,5-Dimethoxy-2,5-dihydrofuranFigure 41. 2,3-DihydrofuranFigure 42. Sodium benzoateFigure 43. 5-Methyl-3-hexene-2-oneFigure 44. 3-Nonen-2-oneFigure 45. Ethyl vinyl ketoneFigure 46. 3-Penten-2-oneFigure 47. Benzyl 4-hydroxyphenyl ketoneFigure 48. Perfluorohydrocarbon oilFigure 49. Quartz
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
10
20
30
40
50
60
70
80
90
100
Figure 5. Nujol; thin film (Nujol is a trade name for mineral oil which is a long chain alkane)
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
CH3, CH2 symmetric
and asymmetric stretches
CH3, CH2 bending
vibrations
(CH2)4
rock
Figure 6. N-Decane, neat liquid, thin film: CH3CH2CH2CH2CH2CH2CH2CH2CH2CH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
20
30
40
50
60
70
80
90
overtones of the benzene ring
Figure 7. Benzene, neat, thin film:
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
1020 8601410
Figure 8. Indene; neat; 0.05 mm cell:
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
HC=Cstretches
CH3,CH2 symmetric
and asymmetric stretches
C=Cstretch
CH3,CH2
bending vibrations
(CH2)4
rocking
out of plane H wag of vinylgroup 900, 1000 cm-1)
Figure 9. 1-Heptene; neat sample, thin film: H2C=CH-CH2CH2CH2CH2CH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
10
20
30
40
50
60
70
80
CH3, CH2 stretching
vibrations CH3, CH2 bending
vibrations
Figure 10. trans -4-Octene, neat liquid, thin film:
H
CH2CH2CH3H
CH3CH2CH2
overtones of the benzene ring
Wavenumbers, cm-1
1000150020002500300035004000
% T
rans
mitt
ance
20
30
40
50
60
70
80
90
100
sp2 C-H stretches sp3 C-H stretches
φ
φ
φ
Figure 11. ortho-Xylene, neat, thin film: CH3
CH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
10
20
30
40
50
60
70
80
90
φ φ
Figure 12. meta-Xylene, neat, thin film: CH3CH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
carbon-carbontriple bond stretch
Figure 13. Phenylacetylene, neat liquid; thin film: H
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
10
20
30
40
50
60
70
80
90
100
H-C=OImpurity peak,probably O-H
Figure 14. Butanal, neat liquid, thin film: CH3CH2CH2CHO
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
C-H stretch of -CHO
Figure 15. Benaldehyde, neat, thin film:
CH
O
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
120
3035 cm-1
Figure 16. Chloroform, thin film: CHCl3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
10
30
50
70
90
0
20
40
60
80
100
Figure 17. Tri-t-butylmethanol, KBr pellet:
C
C
C
OHMe
MeMe
MeMe
Me MeMeMe
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
10
20
30
40
50
60
70
80
90
100
NH2 bend
symmetric andasymmetric NH2
stretches
Figure 18. Butylamine, neat liquid; thin film: CH3CH2CH2CH2NH2
Wavenumber, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
120
symmetric andasymmetric NH2
stretches
Figure 19. Benzamide, KBr pellet:
CNH2
O
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
120
Figure 20. Diethylamine, neat liquid; thin film: CH3CH2NHCH2CH3
Wavnumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
10
20
30
40
50
60
70
80
90
100
Amide I Amide II
Figure 21. N-Methyl acetamide, neat liquid; thin film: CH3CONHCH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 22. Triethylamine, neat liquid; thin film: (CH3CH2)3N
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 23. N,N-Dimethylacetamide, neat liquid; thin film: CH3CON(CH3)2
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100vapor 102 °C
liquid film
Figure 24. The liquid and vapor spectra of n-hexanol.
Wavenumbers, cm-1
1000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
120
Vapor phase spectrum(135 °C)
liquid film
Figure 25. The liquid and vapor spectra of phenol. OH
Wavenumber, cm-1
1000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
120
liquid film
vapor: 134 °C
Figure 26. The liquid and vapor spectra of hexanoic acid.
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 27. Decanoic acid, neat liquid, thin film: CH3(CH2)8CO2H
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
120
symmetric and asymmetric-NO2 stretch
Figure 28. 4-Chloro-2-nitrophenol, KBr pellet:
NO2
OH
Cl
Wavenumber cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 29. Benzoic acid; KBr disk:
COOH
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
20
30
40
50
60
70
80
90
100
Figure 30. Benzoic acid, KBr; band distortions and broadening caused by poor grinding, compare to Figure 29.
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Top: CHCl3 vs CHCl3Bottom: 5% in CHCl3
Figure 31. trans-2-Phenyl-1-cyanoethene, in CHCl3 solution: Ph-CH=CH-CN
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 32. Diethyl acetylenedicarboxylate; neat liquid: C2H5OCO-C≡C-CO2CH2CH3
2987 1370 1040 1724 1255 857 1467 1095 748
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Top: CHCl3 vs CHCl3
Bottom: 2.5 % v/v un CHCl3
Figure 33. Methyl acetate in 0.1 mm NaCl cells: CH3CO2CH3
Wavenumber, cm-1
1000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
120
liquid film
vapor: 106 °C
Figure 34. Vapor and liquid spectra of ethyl n-hexanoate: CH3CH2CH2CH2CH2CO2CH2CH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 35. 5-Hexene-2-one, neat liquid: CH2=CH2CH2CH2COCH3
Wavenumber, cm-1
50010001500200025003000350040004500
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 36. Propionic anhydride, neat liquid: CH3CH2CO2COCH2CH3
1819 1751
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
symmetric and asymmetric O=C-O-C=O stretch
Figure 37. Benzoic anhydride, KBr pellet: C-O-CPh Ph
O O
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
symmetric and asymmetricO=C-O-C=O stretch
Figure 38. 3-Methylpimelic acid anhydride, KBr pellet: OO O
CH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 39. 2,5-Dihydrofuran, neat liquid:
O
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 40. 2,5-Dimethoxy2,5-dihydrofuran, neat liquid:
OOCH3
CH3O
2934 1091 938 1373 1026 906 1196 976 665
2850 1012 798 1345 981 736 1079 892 665
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 41. 2,3-Dihydrofuran, neat liquid:
O
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 42. Sodium benzoate, KBr pellet:
CO2Na
2963 1186 993 1617 1136 914 1275 1056 709
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 43. 5-Methyl-3-hexene-2-one, tech. grade, 80%; neat, thin film:
CH3
CH3
O
CH3
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 44. 3-Nonen-2-one, 95%; neat liquid, thin film: CH3 CH=CH(CH2)4CH3
O
2930 1361 982 1677 1253 606 1467 1167 547
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 45. Ethyl vinyl ketone, neat liquid: CH3CH2COCH=CH2
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 46. 3-Penten-2-one, neat liquid: CH3CH=CHCOCH3
2980 1460 1121 1685 1402 987 1618 1203 960
2974 1444 1181 1675 1361 1127 1620 1254 973
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 47. Benzyl 4-hydroxyphenyl ketone, Nujol mull: O
OH
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
0
20
40
60
80
100
Figure 48. Perfluorohydrocarbon oil; thin film
3368 1338 995 1666 1230 841 1578 1168 728
Wavenumbers, cm-1
5001000150020002500300035004000
% T
rans
mitt
ance
-20
0
20
40
60
80
100
Figure 49. Quartz; KBr pellet.