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. 2017 Jun 24;22(7):1045. doi: 10.3390/molecules22071045

Table 2.

Volatile compounds quantified in two Syrah wine samples using Headspace GC-Flame Ionization Detector (HS-GC-FID) and Stir Bar Sorptive Extraction-GC-Mass Spectrometry (SBSE-GC-MS).

No. Compounds Odor * Concentration ** (μg/L, mean ± SD) OAV ***
Threshold NS YS NS YS
Ethyl esters of straight-chain fatty acid
1 ethyl acetate 12,300 52,086 ± 3892 a 81,445 ± 5481 b 4.23 6.62
2 ethyl propionate 2100 204 ± 25 184 ± 47 <0.1 <0.1
3 ethyl butanoate 20 167 ± 12 a 120 ± 21 b 8.36 6.02
4 ethyl hexanoate 14 533 ± 32 a 151 ± 13 b 38.1 10.8
5 ethyl octanoate 5 275 ± 22 a 58 ± 8 b 54.9 11.7
6 ethyl decanoate 200 99.1 ± 5.3 a 16.3 ± 2 b 0.1–0.5 <0.1
Ethyl esters of branched-chain fatty acid
7 ethyl isobutyrate 15 264 ± 24 a 164 ± 29 b 17.6 10.9
8 ethyl 2-methylbutanoate 18 79.6 ± 3.4 a 48.2 ± 5.4 b 4.42 2.68
9 ethyl isovalerate 3 131 ± 5 a 82 ± 9 b 43.8 27.3
Higher alcohol acetates
10 isobutyl acetate 1800 78.1 ± 6.3 a 61.0 ± 10.1 b <0.1 <0.1
11 butyl acetate 1600 23.4 ± 1.1 a 14.6 ± 1.6 b <0.1 <0.1
12 isoamyl acetate 30 408 ± 26 a 244 ± 13 b 13.6 8.1
13 hexyl acetate 670 3.31 ± 0.37 a 0.76 ± 0.14 b <0.1 <0.1
14 octyl acetate 50,000 3.85 ± 0.08 a 2.5 ± 0.12 b <0.1 <0.1
Aromatic esters and others
15 phenethyl acetate 73 33.3 ± 0.9 a 20.3 ± 1.2 b 0.1–0.5 0.1–0.5
16 ethyl phenylacetate 250 5.51 ± 0.26 5.92 ± 0.26 <0.1 <0.1
17 ethyl dihydrocinnamate 1.6 1.68 ± 0.58 a 0.41 ± 0.26 b 1.05 0.1–0.5
18 ethyl cinnamate 1.1 0.51 ± 0.13 0.37 ± 0.23 0.1–0.5 0.1–0.5
19 methyl anthranilate 3 0.7 ± 0.12 a 1.52 ± 0.24 b 0.1–0.5 0.5–1
20 ethyl anthranilate 16 0.39 ± 0.26 a 1.31 ± 0.26 b <0.1 <0.1
21 methyl vanillate 3000 5.68 ± 2.62 a 13.5 ± 0.14 b <0.1 <0.1
22 ethyl vanillate 990 499± 245 898 ± 307 0.5–1 0.5–1
23 diethyl succinate 120,000 11311 ± 1078 9736 ± 958 <0.1 <0.1
Alcohols
24 1-propanol 50,000 31,180 ± 4642 38,252 ± 2941 0.5–1 0.5–1
25 isobutyl alcohol 40,000 52,872 ± 5530 47,188 ± 4978 1.32 1.18
26 isoamyl alcohol 30,000 123,435 ± 8642 105,594 ± 7374 4.11 3.52
27 1-hexanol 8000 1046 ± 35 a 1279 ± 63 b 0.1–0.5 0.1–0.5
28 cis-3-hexen-1-ol 1000 10.1 ± 4.9 12.7 ± 3.4 <0.1 <0.1
29 trans-2-hexen-1-ol 1000 6.98 ± 2.42 8.77 ± 3.16 <0.1 <0.1
30 1-octen-3-ol 20 14.3 ± 0.4 a 17.8 ± 0.9 b 0.5–1 0.5–1
31 benzyl alcohol 200,000 218 ± 52 a 595 ± 80 b <0.1 <0.1
32 2-phenethanol 14,000 13793 ± 1724 a 9628 ± 801 b 0.5–1 0.5–1
Fatty acids
33 butanoic acid 173 550 ± 63 484 ± 70 3.18 2.80
34 hexanoic acid 420 1489 ± 165 a 1076 ± 140 b 3.55 2.56
35 octanoic acid 500 650 ± 51 579 ± 68 1.30 1.16
36 decanoic acid 1000 122 ± 14 a 72 ± 16 b 0.1–0.5 <0.1
37 2-methylpropanoic acid 2300 730 ± 102 a 544 ± 96 b 0.1–0.5 0.1–0.5
38 2- and 3-methylbutyric acid 33 564 ± 134 a 390 ± 43 b 17.1 11.8
Shikimic acid derivatives (volatile phenols)
39 guaiacol 23 28.8 ± 3.4 a 36.3 ± 3.1 b 1.25 1.58
40 4-methylguaiacol 65 1.98 ± 0.97 a 9.56 ± 0.15 b <0.1 0.1–0.5
41 4-ethylguaiacol 33 1.23 ± 0.43 a 14.75 ± 0.69 b <0.1 0.1–0.5
42 4-vinylguaiacol 1100 20 ± 4.5 17.8 ± 1.4 <0.1 <0.1
43 o-cresol 31 5.86 ± 2.2 3.19 ± 0.17 0.1–0.5 0.1–0.5
44 p-cresol 60 3.4 ± 1.64 4.44 ± 0.28 <0.1 <0.1
45 m-cresol 68 3.11 ± 1.69 2.36 ± 0.11 <0.1 <0.1
46 eugenol 6 6.71 ± 1.25 7.16 ± 3.19 1.12 1.19
47 isoeugenol 6 0.44 ± 0.23 0.61 ± 0.25 <0.1 0.1–0.5
48 4-ethylphenol 440 1.76 ± 0.61 a 101 ± 11 b <0.1 0.1–0.5
49 3-ethylphenol 250 1.86 ± 0.12 a 87 ± 12 b <0.1 0.1–0.5
50 4-vinylphenol 180 56.9 ± 13.3 a 81.2 ± 6.6 b 0.1–0.5 0.1–0.5
Terpenoids
51 linalool 15 11.6 ± 0.3 a 1.81 ± 0.05 b 0.1–0.5 0.1–0.5
52 α-terpineol 250 14.6 ± 0.1 a 12 ± 0.7 b <0.1 <0.1
53 citronellol 100 1.76 ± 0.03 a 0.66 ± 0.05 b <0.1 <0.1
54 geraniol 30 6.13 ± 0.72 a 1.73 ± 0.36 b 0.1–0.5 <0.1
55 nerol 300 8.98 ± 0.65 10.4 ± 1.4 <0.1 <0.1
56 rose oxide 0.2 0.03 ± 0.01 0.04 ± 0.03 0.1–0.5 0.1–0.5
57 linalool oxide 3000 1.72 ± 0.36 a 5.69 ± 0.49 b <0.1 <0.1
C13-norisoprenoids
58 β-damascenone 0.05 2.81 ± 0.1 a 0.22 ± 0.03 b 56.1 24.4
59 β-ionone 5 0.12 ± 0.02 0.09 ± 0.08 <0.1 <0.1
Ketone and lactones
60 γ-octalactone 400 6.24 ± 1.56 5.15 ± 0.6 <0.1 <0.1
61 γ-nonalactone 30 8.33 ± 0.86 11 ± 1.98 0.1–0.5 0.1–0.5
62 γ-decalactone 88 0.6 ± 0.04 a 1.34 ± 0.29 b <0.1 <0.1
63 γ-undecalactone 150 5.61 ± 0.72 a 3.71 ± 0.83 b <0.1 <0.1
64 cis-whiskylactone 74 12.7 ± 2.5 a 33.9 ± 1.3 b 0.1–0.5 0.1–0.5
65 trans-whiskylactone 32 31.5 ± 4.2 58.3 ± 2.1 0.5–1 1.82
66 2-aminoacetophenone 1.4 1.01 ± 0.15 1.18 ± 0.11 0.5–1 0.5–1
Aldehydes
67 acetaldehyde 500 22,343 ± 1397 a 31,905 ± 2231 b 44.7 63.8
68 cinnamaldehyde 1180 0.18 ± 0.03 a 0.46 ± 0.16 b <0.1 <0.1
69 vanillin 200 88.8 ± 6.7 a 110 ± 8 b 0.1–0.5 0.5–1
Methoxypyrazines
70 3-isopropyl-2-methoxypyrazine 0.015 0.001 ± 0.0003 N.D. <0.1 <0.1
71 3-sec-butyl-2-methoxypyrazine 0.015 N.D. 0.0012 ± 0.0004 <0.1 <0.1
72 3-isobutyl-2-methoxypyrazine 0.002 0.0017 ± 0.001 0.0012 ± 0.0004 0.5–1 0.5–1

* Odor threshold of the volatiles were presented in μg/L. They were measured in model wine, water/ethanol (90 + 10, w/w) unless indicated, and referenced from the literature: [3,34,35,37,38,39,40,41,42,43,44,45]; ** Different letters within rows indicates statistical differences by the Duncan test (p < 0.05); *** OAV means odor activity value, calculated as the ratio between the concentration of the individual compound in wine and the threshold concentration of this substance.