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. 2016 Dec 15;11(12):e0168242. doi: 10.1371/journal.pone.0168242

Table 2. Compounds emitted by D. cf. concentrica.

Retention time (min) Suggested compound* Molecular formula Main fragments (m/z) Area (%) MW
2.2 3-methyl-1-butanol C5H12O 42, 55, 57, 70 1.0 88
2.25 2-methyl-1-butanol C5H12O 41, 56, 57, 70 1.1 88
2.7 1-methyl-1,3-cyclohexadiene C7H10 77, 79, 91, 94 6.5 94
2.8 1-methyl-1,4-cyclohexadiene C7H10 77, 79, 91, 94 3.9 94
4.1 4-heptanone C7H14O 43, 71, 114 0.2 114
4.3 isoamyl acetate C7H14O2 traces 130
5.2 4-heptyn-2-ol C7H12O 45, 53, 67 68, 97, 112 4.2 112
5.5 2-octenal C8H14O 42, 55, 57 84, 98, 126 33.3 126
6.3 octanal C8H16O 69, 71, 72 83, 84, 95 110, 128 4.7 128
7.2 4,4-dimethyl-1,3-cyclopentanedione C7H10O2 41, 56, 126 4.0 126
7.7 2,2,5-trimethylcyclopentanone C8H14O 41, 56, 126 16.5 126
10.5 phenyl ethyl alcohol C8H10O 65, 91, 92, 122 1.9 122
18.2 β-elemene C15H24 41, 53, 55, 67, 68, 79, 81, 93, 107, 121, 133, 135, 147, 149, 161, 189, 204 0.06 204
18.4 β-elemene C15H24 41, 53, 55, 67, 68, 79, 81, 93, 107, 121, 133, 135, 147, 149, 161, 189, 204 1.0 204
19.4 (+)-α-funebrene C15H24 - traces -
19.6 α-guaiene C15H24 41, 53, 55, 67, 79, 81, 93, 105, 121, 133, 147, 161, 189, 204 0.1 204
19.9 2-(4-hydroxyphenyl)ethanol C8H10O2 ? 0.08 204
20.7 terpenes C10H10O3 108, 136, 137, 163, 178 9.0 178
21.0 β-selinene C15H24 41, 53, 55, 67, 79, 81, 91, 93, 107, 121, 133, 147, 161, 175, 189, 204 0.7 204
21.2 α-selinene C15H24 41, 53, 55, 67, 79, 81, 91, 93, 107, 121, 133, 147, 161, 175, 189, 204 0.2 204
21.4 α-bulnesene C15H24 41, 53, 55, 67, 79, 81, 91, 93, 107, 121, 133, 147, 161, 189, 204 0.7 204
21.6 germacrene A C15H24 - traces -
21.8 7-epi-α-selinene C15H24 - traces -
22.0 dauca-4(11),8-diene C15H24 - traces -
22.9 veratryl acetone C11H14O3 - traces -
25.1 3-methoxy-2-naphthol C11H10O2 77, 131, 159, 174 1.6 174
25.2 pogostol C15 H26O 41, 53, 55, 71, 81, 93, 107, 121, 131, 147, 161, 189, 204 1.2 222

* identified according to NIST Mass Spectral Library, ver. 2.0 d