Table 2 Retention time in HPLC ( t R ) and MS information of selected desulfoglucosinolates (dGSLs), along with the evidence for the identity of the reference compound or reference material. Those with an asterisk (*) after the number were only tentatively identified.
Global number and of dGSLs (Da) a Masses t R of Evidence for
acronym dGSLs dGSL identity b
(min)
GSL Desulfo Desulfo
[M H]+ + [M Na]+ +
107 Pren 280 302 1.5 NMR
56 1mEt 282 304 2.4 NMR
12 Buen 294 316 2.8 NMR
62 2mPr 296 318 3.6 NMR
61 1mPr 296 318 4.5 NMR
[42] 3hPr 298 320 1.1 Col-0 c
57 R 2hmEt 298 320 1.4 NMR
101 Peen 308 330 5.3 NMR
24 R R2hBuen 310 332 1.3 NMR
24 S * S2hBuen 310 332 1.4 Crambe d
[26] 4hBu 312 334 1.2 Col-0 c
30 1hmPr 312 334 2.4 NMR
31 2h2mPr 312 334 – –
58 3mPe 324 346 7.2 NMR
95 * 3mSp 328 350 4.2 Iberis d , hrMS,
MS2
11 BZ 330 352 5.4 NMR
141 3hmPe 340 362 4.0 NMR
149 2h3mPe 340 362 5.3 NMR
83 4mSbuen 340 362 5.8 NMR/Vis92
84 4mSb 342 364 5.6 NMR
73 3mSOp 344 366 1.2 Comm., MS2
105 PE 344 366 6.6 NMR
23 4hBZ 346 368 2.6 NMT
22 3hBZ 346 368 3.1 NMR/Pag17
63 4mSObuen 356 378 1.4 NMR/Ior08
64 4mSOb 358 380 1.4 NMR
40 R EBAR 360 382 4.4 NMR,
B. vulg. P c
40 S BAR 360 382 4.9 NMR,
B. vulg. G c
140 4hPE 360 382 4.8 NMR
148 3hPE 360 382 5.4 NMR
43 IM 369 391 6.0 NMR
72 5mSOp 372 394 2.2 Col-0 c
139 R 4hEBAR 376 398 2.1 NMR
139 S 4hBAR 376 398 2.2 NMR
142 R 3hEBAR 376 398 2.5 NMR
151 4h3moBZ 376 398 3.0 NMR/Pag17
87 7mSh 384 406 8.6 Col-0 c
[154] 1hIM 385 407 6.4 MS2/Pfa16
67 6mSOh 386 408 4.7 Col-0 c
15 3,4moBZ 390 412 5.8 NMR/Pag17
92 8mSo 398 420 9.5 NMR
48 4moIM 399 421 6.7 NMR
47 1moIM 399 421 7.6 NMR/Bla20
66 7mSOh 400 422 5.6 NMR
[10] 3BzOp 402 424 7.6 Col-0 c
x1 3/ 406 428 2.4 NMR
4hmoEBAR
152 4h3,5moBZ 406 428 4.7 NMR/Pag17
69 8mSOo 414 436 6.5 NMR
5 4BzOb 416 438 8.3 Col-0 c
114 3,4,5moBZ 420 442 6.2 NMR/Pag17
68 * 9mSOn 428 450 7.3 MS2 (Fig. 1)
138 1,4moIM 429 451 8.0 NMR
80 8mSO 2 o 430 452 6.8 NMR
117 5BzOp 430 452 8.9 Col-0 c
79 9mSO 2 n 444 466 7.7 NMR
127 6 ′ Bz 4mSb 446 468 9.8 Col-0 c
77 10mSO 2 d 458 480 8.4 NMR
109 * 2RhaOBZ 492 514 5.9 R. odorata d
129 6’iF PE 520 542 9.8 NMR,
B. vulg. P c
125 6 ′ Bz 4BzOb 520 542 10.9 Col-0 c
131 R 6’iF EBAR 536 558 9.0 NMR,
B. vulg. P c
persistent identifier: http://table.plazi.org/id/BAAF6606FFAAFFF4634CFF30FBB5FEF1
other formats: Plain XML JSON CSV TSV
Published as part of Agerbirk, Niels, Hansen, Cecilie Cetti, Olsen, Carl Erik, Kiefer, Christiane, Hauser, Thure P., Christensen, Stina, Jensen, Karen R., Ørgaard, Marian, Pattison, David I., Lange, Conny Bruun Asmussen, Cipollini, Don, Koch, Marcus A. (2021). Glucosinolate profiles and phylogeny in Barbarea compared to other tribe Cardamineae (Brassicaceae) and Reseda (Resedaceae), based on a library of ion trap HPLC-MS / MS data of reference desulfoglucosinolates. Phytochemistry (112658) 185: 1-19. DOI: 10.1016/j.phytochem.2021.112658, URL: http://dx.doi.org/10.1016/j.phytochem.2021.112658 on page 4