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. 2017 Jun 15;26(2):529–544. doi: 10.1016/j.jfda.2017.05.004

Table 1B.

Fast gas chromatography determination of T. zygis chem. linalool and T. hyemalis EO compounds.

N a LRIb LRIc Compound Qualifying and quantitation ionsd (m/z) Tzl1 Tzl2 Th1 Th2 IM
Concentration (mM ± SD) Area (% ± SD) Concentration (mM ± SD) Area (% ± SD) Concentration (mM ± SD) Area (% ± SD) Concentration (mM ± SD) Area (% ± SD)
1 928 929 α-Thujene 39, 77, 93, 136 0.3c ± 0.0 0.2d ± 0.0 0.7c ± 0.0 0.5d ± 0.0 1,2
2 930 938 α-Pinene 77, 93, 105, 121 170.1a ± 11.8 3.0d ± 0.0 185.9a ± 17.8 3.2c ± 0.1 194.8a ± 16.6 3.7d ± 0.1 187.8a ± 11.6 4.0c ± 0.0 1,2,3
3 943 955 Camphene 79, 93, 107, 121 68.9a ± 4.5 0.8d ± 0.0 75.9a ± 7.5 1.0c ± 0.0 108.0b ± 9.1 1.6d ± 0.1 474.8a ± 7.7 6.5c ± 0.1 1,2,3
4 964 976 Sabinene 41, 77, 91, 93 0.9c ± 0.0 1.0c ± 0.0 1.7 ± 0.0 1,2
5 970 982 β-Pinene 69, 77, 93, 121 15.6a ± 1.1 0.4d ± 0.0 15.9a ± 0.7 0.4c ± 0.0 18.8b ± 1.3 0.6d ± 0.0 138.7a ± 10.5 2.7c ± 0.0 1,2,3
6 984 985 3-Octanone 43, 57, 71, 99 0.1c ± 0.0 0.1c ± 0.0 1,2
7 979 989 Myrcene 41, 69, 79, 93 591.8b ± 3.6 7.4c ± 0.1 633.7a ± 18.5 7.5c ± 0.3 316.5b ± 3.9 2.6d ± 0.1 456.3a ± 16.2 4.5c ± 0.0 1,2,3
8 985 1002 3-Octanol 41, 59, 83, 101 0.1c ± 0.0 0.1c ± 0.0 1,2
9 999 1010 α-Phellandrene 77, 93, 119, 136 33.2a ± 2.1 0.4c ± 0.0 22.4b ± 1.4 0.3d ± 0.0 16.6b ± 1.1 0.2d ± 0.0 25.2a ± 2.8 0.4c ± 0.0 1,2,3
10 1005 1012 3-Carene 77, 79, 91, 93 0.1 ± 0.0 1,2
11 1008 1019 α-Terpinene 77, 93, 121, 136 408.2a ± 14.2 4.0c ± 0.0 149.6b ± 0.3 3.1d ± 0.1 107.7a ± 7.6 2.2c ± 0.1 20.4b ± 1.0 0.3d ± 0.0 1,2,3
12 1011 1027 p-Cymene 91, 117, 119, 134 156.7a ± 11.3 3.0c ± 0.0 119.2b ± 7.5 2.3d ± 0.1 1260.7a ± 13.0 29.2c ± 0.9 74.4b ± 4.9 1.3d ± 0.0 1,2,3
13 1020 1029 Limonene 68, 79, 93, 121 230.5a ± 15.0 2.7d ± 0.0 234.9a ± 5.4 3.0c ± 0.1 139.8a ± 12.6 1.9c ± 0.1 67.6b ± 6.9 0.8d ± 0.0 1,2,3
14 1024 1031 Z-β-Ocimene 41, 79, 93, 105 92.2a ± 4.7 0.7c ± 0.0 74.0b ± 5.4 0.5d ± 0.0 55.6b ± 5.0 0.4d ± 0.0 66.6a ± 2.3 0.8c ± 0.1 1,2,3
15 1023 1034 1,8-Cineole 43, 81, 93, 108 12.5a ± 1.1 0.3c ± 0.0 12.8a ± 0.6 0.3c ± 0.0 130.5b ± 11.1 3.1d ± 0.0 1569.7a ± 9.9 36.9c ± 0.3 1,2,3
16 1036 1041 E-β-Ocimene 41, 79, 93, 105 tr tr 0.1d ± 0.0 4.5c ± 0.0 1,2
17 1053 1059 γ-Terpinene 77, 93, 121, 136 413.7a ± 21.4 7.7c ± 0.1 369.5b ± 13.4 6.1d ± 0.2 276.5a ± 13.3 4.8c ± 0.1 117.9b ± 7.7 1.8d ± 0.0 1,2,3
18 1070 1072 E-Sabinene hydrate 77, 93, 121, 136 164.2a ± 10.2 2.4d ± 0.0 186.1a ± 15.0 2.7c ± 0.0 0.1d ± 0.0 31.3 ± 1.8 0.4c ± 0.0 1,2,3
19 1080 1088 Terpinolene 93, 105, 121, 136 1.4c ± 0.0 1.3d ± 0.0 0.4c ± 0.0 0.2d ± 0.0 1,2
20 1089 1090 Z-Lilalool oxide 43, 59, 68, 111 0.2c ± 0.0 0.2c ± 0.0 0.1 ± 0.0 1,2
21 1081 1105 Linalool 41, 69, 93, 121 1867.8b ± 33.9 41.3d ± 0.2 2064.7a ± 32.6 43.4c ± 0.4 630.7a ± 13.5 12.5c ± 0.1 495.9b ± 14.0 7.8d ± 0.1 1,2,3
22 1089 1110 Hotrienol 71, 82, 119, 134 0.7c ± 0.0 0.7c ± 0.0 1,2
23 1071 1110 β-Terpinene 77, 93, 121, 136 0.4c ± 0.0 0.5c ± 0.0 0.1d ± 0.0 0.2c ± 0.0 1,2
24 1110 1132 6-Camphenol 41, 77, 93, 108 0.5d ± 0.0 0.5c ± 0.0 1,2
25 1132 1152 Hexyl isobutyrate 43, 56, 71, 89 0.3c ± 0.0 0.3c ± 0.0 0.1d ± 0.0 0.2c ± 0.0 1,2
26 1148 1157 Camphor 81, 95, 108, 152 18.3b ± 0.4 0.2d ± 0.0 26.5a ± 0.5 0.3c ± 0.0 31.3a ± 0.8 0.4d ± 0.0 803.0a ± 20.1 9.4c ± 0.1 1,2,3
27 1157 1179 Lavandulol 41, 69, 111, 123 0.1 ± 0.0 0.1d ± 0.0 0.6c ± 0.0 1,2
28 1174 1181 Borneol 41, 95, 110, 121 115.3b ± 3.9 1.5d ± 0.0 137.6a ± 3.8 1.8c ± 0.1 157.5b ± 4.1 2.1d ± 0.1 419.3a ± 13.3 2.6c ± 0.1 1,2,3
29 1161 1187 Terpinen-4-ol 71, 93, 121, 136 391.4a ± 8.4 13.0c ± 0.1 389.9a ± 15.5 12.9c ± 0.3 155.9a ± 6.2 5.5c ± 0.1 37.0b ± 1.2 1.1d ± 0.0 1,2,3
30 1172 1197 p-Cymene-8-ol 65, 91, 117, 132 0.1c ± 0.0 0.1c ± 0.0 0.2 ± 0.0 1,2
31 1192 1202 α-Terpineol 68, 93, 121, 136 126.3a ± 6.5 1.6c ± 0.0 137.9a ± 5.5 1.8c ± 0.1 147.8b ± 5.7 2.3c ± 0.0 174.4a ± 8.1 2.4c ± 0.1 1,2,3
32 1206 1210 E-Dihydrocarvone 67, 95, 109, 152 0.1d ± 0.0 0.2c ± 0.0 1,2
33 1204 1214 Verbenone 91, 107, 135, 150 12.3 ± 0.1 0.2c ± 0.0 0.1d ± 0.0 69.9 ± 2.1 0.8 ± 0.1 1,2,3
34 1206 1224 Carveol 91, 105, 119, 134 0.1c ± 0.0 0.1c ± 0.0 1,2
36 1215 1230 Methyl ether of thymol 91, 119, 149, 164 0.1c ± 0.0 0.1c ± 0.0 0.3 ± 0.0 1,2
37 1208 1232 Isobornyl formate 93, 95, 121, 136 0.1d ± 0.0 0.2c ± 0.0 1,2
38 1231 1239 Methyl ether of carvacrol 77, 91, 117, 134 8.8a ± 0.3 0.1c ± 0.0 5.4b ± 0.5 0.1d ± 0.0 22.5 ± 0.3 0.3 ± 0.0 1,2,3
39 1236 1246 Linalyl acetate 41, 69, 93, 121 54.0a ± 1.8 0.9c ± 0.0 51.2a ± 1.2 0.9c ± 0.0 42.0a ± 0.7 0.7c ± 0.0 38.7b ± 1.1 0.6d ± 0.0 1,2,3
40 1232 1256 Geraniol 41, 69, 79, 93 8.1a ± 0.7 0.1c ± 0.0 9.3a ± 0.6 0.1c ± 0.0 6.0b ± 0.3 0.1d ± 0.0 15.3a ± 0.4 0.2c ± 0.0 1,2,3
41 1272 1283 Lavandulyl acetate 43, 69, 93, 121 0.1 ± 0.0 1,2
42 1285 1288 Bornyl acetate 43, 95, 121, 136 0.1d ± 0.0 8.5 ± 0.2 0.2c ± 0.0 8.8b ± 0.5 0.2d ± 0.0 28.7a ± 0.7 0.5c ± 0.0 1,2,3
44 1266 1309 Thymol 91, 115, 135, 150 101.4a ± 1.5 1.0c ± 0.1 18.1b ± 0.5 0.1d ± 0.0 1210.6 ± 6.6 18.5 ± 0.9 1,2,3
45 1278 1315 Carvacrol 77, 91, 135, 150 9.5 ± 0.0 0.1 ± 0.0 75.1 ± 1.8 1.8 ± 0.1 1,2,3
47 1334 1335 δ-Elemene 79, 93, 107, 121 0.1d ± 0.0 0.3c ± 0.0 1,2
48 1360 1379 Geranyl Acetate 41, 69, 93, 121 0.1d ± 0.0 0.2c ± 0.0 5.8b ± 0.3 0.1d ± 0.0 23.9a ± 0.6 0.8c ± 0.0 1,2,3
49 1421 1427 E-β-Caryophyllene 41, 79, 93, 133 25.5b ± 0.1 1.1c ± 0.0 26.8a ± 0.8 1.2c ± 0.1 25.6b ± 0.4 1.1d ± 0.0 49.4a ± 1.3 2.0c ± 0.1 1,2,3
50 1455 1447 Aromadendrene 91, 133, 161, 204 0.1 ± 0.0 1,2
51 1454 1467 α-Humulene 80, 93, 121, 147 tr 0.1 ± 0.0 0.1d ± 0.0 5.8 ± 0.3 0.2c ± 0.0 1,2,3
52 1475 1475 α-Amorphene 105, 119, 161, 204 0.3 ± 0.0 1,2
53 1480 1488 Germacrene D 91, 105, 119, 161 tr 0.1 ± 0.0 0.2 ± 0.0 1,2
54 1496 1496 Ledene 107, 135, 171, 204 0.1d ± 0.0 1.2c ± 0.1 1,2
55 1514 1527 δ-Cadinene 134, 161, 189, 204 0.1d ± 0.0 0.6c ± 0.0 1,2
56 1567 1562 Sesquisabinene hydrate 69, 119, 161, 207 0.3 ± 0.0 1,2
57 1575 1594 Caryophyllene oxide 41, 79, 91, 105 9.9b ± 0.2 0.1c ± 0.0 11.5a ± 0.8 0.1c ± 0.0 15.9a ± 1.2 0.1c ± 0.0 13.5a ± 4.0 0.1d ± 0.0 1,2,3
58 1595 1623 α-Cedrol 91, 119, 161, 204 0.2 ± 0.0 1,2
Oxygenated terpenes:
Alcohol 62.6 64.3 43.1 15.4
Ketone 0.5 0.6 1.2 9.4
Aldehyde 0.0 0.0 0.0 0.0
Ester 1.5 1.9 1.1 2.1
Ether 0.8 0.8 3.9 37.0
Monoterpene hydrocarbons 33.2 30.5 48.8 30.2
Oxygenated monoterpenes 65.1 67.3 49.1 63.5
Sesquiterpene hydrocarbons 1.2 1.6 1.7 5.7
Oxygenated sesquiterpenes 0.1 0.1 0.1 0.4
Total terpene hydrocarbons 34.4 32.1 50.5 35.9
Total oxygenated terpenes 65.2 67.4 49.2 63.9
Non isoprenoid components 0.4 0.5 0.3 0.2

IM = Identification method: 1 = by LRI, 2 = by NIST 08 & Wiley 7, 3 = by comparison with pure compounds. tr = Traces (<0.1%).

a

N = Reference number for statistical PCA graphs.

b

LRI = Linear Retention Index from databases NIST 08 & Wiley 7.

c

LRI = Linear Retention Index calculated from the homologous series of n-alkanes (C7–C30).

d

Ions used for quantitation are in bold.