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. 2014 Dec 3;23(2):253–259. doi: 10.1016/j.jfda.2014.10.006

Table 2.

Volatile extract composition of Borago officinalis seeds.

No. Retention time on DB-WAX (min) Compounds RIs Identification and MS ions (EI)a Total area (%) Approximate concentration (μg/mL extract)b

DB-WAX HP-1
1 2.64 3-Methyl butanal 925 <700 ++++; M+ 86 (16.67), 44 10.8 B
2 3.50 2-Pentanone 987 <700 ++++; M+ 86 (20.02), 43 18.0 A
3 5.00 2,3-Pentanedione 1069 <700 +++; M+ 100 (16.32), 43 0.7 C
4 5.41 Hexanal 1086 779 ++++; M+ 100 (1.21), 44 10.8 B
5 5.97 3-Pentanol 1110 <700 ++++; M+ 88 (0.65),59 0.4 B
6 6.28 2-Pentanol 1124 <700 ++++; M+ 88 (1.03), 45 1.2 C
7 6.62 2-Butyl furan 1139 880 +++; M+ 124 (13.46), 81 0.3 C
8 6.85 1-Butanol 1148 <700 ++++; M+ 74 (1.86), 56 0.1 D
9 7.81 2-Heptanone 1185 872 ++++; M+ 114 (6.60), 43 0.9 C
10 7.90 Heptanal 1188 881 ++++; M+ 114 (2.01), 70 1.2 C
11 8.24 Dodecane 1200 1199 ++++; M+ 170 (4.12), 57 0.2 D
12 8.71 (E)-2-Hexenal 1219 829 +++; M+ 98 (22.10), 41 0.7 C
13 9.12 2-Pentyl-furan 1236 981 +++; M+ 138 (18.35), 81 1.9 C
14 9.60 1-Pentanol 1254 759 ++++; M+ 88 (1.16), 42 1.3 C
15 9.74 Styrene 1259 875 +++; M+ 104 (100.00), 103 (48.72) 0.3 C
16 9.93 Methyl-pyrazine 1267 796 +++; M+ 94 (100.00), 67 (47.31) 0.5 C
17 10.51 2-Octanone 1287 964 +++; M+ 128 (6.18), 43 0.7 C
18 10.63 Octanal 1290 980 ++++; M+ 128 (1.20), 43 0.8 C
19 10.87 1-Hydroxy-2-propanone 1299 <700 +++; M+ 74 (11.62), 43 0.3 C
20 10.96 1-Octen-3-one 1302 959 ++++; M+ 126 (0.96), 55 0.5 C
21 11.39 2,5-Dimethyl-pyrazine 1320 885 +++; M+ 108 (93.21), 42 0.3 C
22 11.50 (Z)-2-Heptenal 1325 932 +++; M+ 112 (6.85), 41 0.8 C
23 11.57 2,6-Dimethyl-pyrazine 1327 882 ++++; M+ 108 (100.00), 42 (90.15) 0.3 C
24 11.67 2-Methyl-3-octanone 1331 1074 +++; M+ 142 (4.55), 43 0.2 D
25 12.32 1-Hexanol 1356 862 ++++; M+ 102 (0.58), 56 0.9 C
26 13.07 2-Ethyl-6-methyl-pyrazine 1383 976 +++; M+ 122 (65.87), 121 0.2 D
27 13.25 2-Nonanone 1390 1072 +++; M+ 142 (8.94), 43 0.5 C
28 13.38 Nonanal 1394 1083 ++++; M+ 142 (1.01), 57 1.6 C
29 13.70 (E)-3-Octen-2-one 1406 1014 +++; M+ 126 (14.38), 43 0.3 C
30 14.26 (E)-2-Octenal 1430 1034 +++; M+ 126 (3.29), 41 0.8 C
31 14.88 1-Octen-3-ol 1454 981 ++++; M+ 128 (0.60), 57 1.6 C
32 14.96 Acetic acid 1457 <700 ++++; M+ 60 (76.08), 43 2.7 B
33 15.21 Furfural 1467 802 ++++; M+ 96 (100.00), 95 (99.23) 1.8 C
34 15.76 (Z)-6-Nonenal 1488 1007 +++; M+ 140 (0.85), 41 0.2 D
35 15.93 2-Decanone 1494 1173 +++; M+ 156 (5.11), 58 0.4 C
36 16.53 Pyrrole 1518 748 ++++; M+ 67 (100.00), 39 (64.74) 0.3 C
37 16.60 Benzaldehyde 1521 929 ++++; M+ 106 (96.18), 77 0.8 C
38 16.93 2-Nonenal 1535 1144 +++; M+ 140 (3.96), 43 0.5 C
39 17.33 Linalool 1552 1088 ++++; M+ 154 (1.24), 71 0.2 D
40 17.53 1-Octanol 1560 1069 ++++; M+ 130 (0.34), 56 0.4 C
41 17.88 5-Methyl-2-furancarboxaldehyde 1574 939 +++; M+ 110 (100.00), 109 (79.03) 0.2 D

EI = electron impact; GC–MS = gas chromatography–mass spectrometry; RI = retention index.

a

The reliability of the proposed identification has been indicated according to the following: ++++, mass spectrum and retention indices both on polar and nonpolar columns agreed with those of the standards, mass spectral libraries and literature; +++, mass spectrum and retention indices both on polar and nonpolar columns agreed with mass spectral libraries and the literature; ++, mass spectrum and retention index on a polar column agreed with the mass spectral libraries and the literature. MS ions (EI) were given by GC-MS on a DB-WAX column. They consisted of molecular ion M+ (relative abundance) and the base peak ion, or the peak ion with the second-highest relative abundance if the molecular ion was the base peak.

b

A: 500–1000; B: 100–500; C: 10–100; and D: 1–10.