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. 2019 Feb 13;9:1884. doi: 10.1038/s41598-018-38036-x

Table 2.

Identification of phenolic compounds from various leaf materials by UHPLC/ESI‐HR‐QTOFMS.

Leaf material Rt (min) UV λmax (nm) Experi-mental mass (m/z) MS/MS fragments Compound Molecular formula Theoretical mass (m/z) Mass error (ppm) ref.
Spinach 11.8 255, 350 789.2270 333 Patuletin-3-O-β-D-glucopyranosyl-(1 → 6)-[β-D-apiofuranosyl-(1 → 2)]-β-D-glucopyranoside C33H40O22 789.2083 −9.5 25
12.3 255, 350 657.1630 347, 333 Patuletin-3-O-β-D-glucopyranosyl-(1 → 6)-β-Dglucopyranoside C28H32O18 657.1661 −4.7 25
12.8 255, 350 803.2190 421, 347 Spinacetin-3-O-β-D-glucopyranosyl-(1 → 6)-[β-D-apiofuranosyl-(1 → 2)]-β-D-glucopyranoside C34H42O22 803.2240 −6.3 25
18.0 254, 278, 340 521.0931 345, 330 5, 3, 4 -Trihydroxy-3-methoxy-6:7-methylendioxyflavone-4 - β-D-glucuronide C23H20O14 521.0926 1.0 25
Kale 8.4 254, 340 789.2081 425, 347, 303, 204, 132, 84 Quercetin-3-diglucoside-7-glucoside C33H40O22 789.2084 −0.4 22, 23
8.9 258, 338 773.2136 347, 287, 186, 132, 84 Kaempferol-3-diglucoside-7-glucoside C33H40O21 773.2135 0.1 22, 23
9.2 258, 338 934.2633 633, 571, 449, 347, 287, 84 Kaempferol-3-diglucoside-7-diglucoside C39H50O26 934.2585 5.2 22, 23
Collards 8.9 268, 344 773.2206 541, 347, 287 Kaempferol-3-diglucoside-7-glucoside C33H40O21 773.2135 9.2 21, 22
9.5 253, 268, 338 965.2561 449, 355, 287, 193, 133, 84 Kaempferol-3-hydroxyferuloyldiglucoside-7-glucoside C43H48O25 965.2557 0.4 21, 22
9.7 338 935.2561 409, 287, 163, 84 Kaempferol-3-caffeoyldiglucoside-7-glucoside C42H46O24 935.2451 11.7 21, 22
10.1 338 965.2590 409, 303 Quercetin-3-O-feruloyldiglucoside-7-glucoside C43H48O25 965.2557 3.4 21, 22
10.5 254, 268, 334 1111.3239 949, 532, 449, 287, 177, 84 Kaempferol-3-feruloyltriglucoside-7-glucoside C49H58O29 1111.313 9.2 21, 22
Mustard 8.9 268, 344 773.2206 541, 347, 287 Kaempferol-3-diglucoside-7-glucoside C33H40O21 773.2135 9.2 21, 22
9.5 253, 268, 338 965.2625 449, 355, 287, 193, 161, 133, 84 Kaempferol-3-hydroxyferuloyldiglucoside-7-diglucoside C43H48O25 965.2557 7.0 21, 22
9.7 253, 268, 338 935.2463 409, 287, 163, 135, 84 Kaempferol-3-caffeoyldiglucoside-O-glucoside C42H46O24 935.2451 1.2 21, 22
10.1 253, 338 965.2590 409, 303 Quercetin-3-O-feruloyldiglucoside-7-O-glucoside C43H48O25 965.2557 3.4 21, 22
10.5 253, 268, 334 611.1577 287 Kaempferol-3-diglucoside C27H30O16 611.1606 −4.8 21, 22
10.8 268, 338 641.1695 317 Isorhamnetin-3-diglucoside C28H32O17 641.1712 −2.7 21, 22
14.8 254, 266, 352 479.1155 317 Isorhamnetin-3-glucoside C22H22O12 479.1184 −6.1 21, 22
Watermelon 7.5 246, 330 707.2320 365, 163, 89 Unknown
8.5 n.d. 827.3534 425, 319, 157, 107 Unknown
15.7 250, 332 587.2183 319, 163, 107, 89 Unknown

n.d.- indicates not detecte.