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. 2015 Jan 9;5:765. doi: 10.3389/fpls.2014.00765

Table 3.

Phytochemicals identified in shoot and root extracts and root exudates of six canola genotypes using LC-QTOF-MS in negative mode and matched with data from two data bases.

SL Name Formula RT (min) Mass Score m/z Shoot extracts* Root extracts* Root exudates*
1 Malonic acid C3 H4 O4 0.696 104.011 73.64 104.01095 3, 4, 6 4, 6 4, 6
2 Isocitric Acid C6 H8 O7 0.931 192.0259 97.45 192.0210 1, 2, 3, 4, 5, 6 1, 2, 3, 4, 5, 6 1, 2, 3, 4, 5, 6
3 2-hydroxy-3,4-dimethoxybenzoic acid C9 H8 O4 4.857 180.043 76 180.04225 1, 2, 3, 4, 5, 6 1, 2, 3, 4, 5, 6
4 Sinapyl alcohol C11 H14 O4 4.987 210.087 94.06 210.08920 1, 2, 3, 4, 5, 6 1, 2, 3, 4, 5, 6 1, 2
5 Rutin C27 H3 0 O16 5.002 610.1559 78.19 610.15338 1, 2, 3, 4, 5, 6 1, 2, 3, 4, 5, 6
6 p-hydroxybenzoic acid C7 H6 O3 5.348 138.0303 78.37 138.03169 1, 2, 3, 4, 5, 6 1, 2
7 Vanillic acid C8 H8 O4 5.59 168.0414 81.29 168.04225 1, 2, 3, 4, 5, 6 1, 2, 3, 4, 5, 6
8 trans-3-hydroxycinnamic acid C9 H8 O3 6.356 164.0458 73.8 164.0473 1, 2, 3, 4, 5, 6
9 Dimethoxy-4-hydroxycinnamic acid C11 H12 O5 6.631 224.0693 98.34 224.06847 1, 2, 3, 4, 5, 6 1, 2, 4, 6
10 2-phenylethyl glucosinolates C9H9NS 6.832 163.24 90.03 163.04556 2, 4,5 2, 4, 5
11 Quercitin C15 H10 O7 7.159 302.046 69.87 302.04265 1, 2, 3, 4, 5, 6 1, 2, 3, 4, 5, 6 3
12 3,5,6,7,8 pentahydroxy flavone C15H10 O7 7.50 302.205 70.05 302.04265 1,2 1, 2
13 Jasmonic acid C12 H18 O3 8.224 210.1224 81.95 210.12559 1, 2, 3, 5
14 Methyl jasmonate C13 H20 O3 9.541 224.1386 72.05 224.14124 1, 2 1, 2

*Number indicates whether the compound is found in the tissue of the six genotypes: 1, Av-opal; 2, Pak85388-502; 3, Av-garnet; 4, Barossa; 5, Cb-argyle; 6, Atr-409; “–,” not present.