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. 2021 Aug 20;13(8):2870. doi: 10.3390/nu13082870

Table 2.

Chemical composition of extract conjugated with arginie (E2) and quantification of major compounds using HPLC-DAD-MS.

No Compound Name Retention Time [min] UV-Vis Maxima [nm] MS− Ions MS2− Ions MS+ Ions MS2+ Ions Content/μg/mg Qunatification Standard Ions Used for Qunatification
A quinic acid s 1.4 227, 275 191 - 193 - 0.23 ± 0.21 chlorogenic acid 191
B phenolic acid derivative 11.7 278 299 111, 173 b, 255 301 109, 224 b, 255 3.79 ± 0.05 chlorogenic acid 299
C phenolic acid derivative 14.0 279, 311 299 109, 149, 173 b, 262, 281 301 - 0.06 ± 0.04 chlorogenic acid 299
D 3-O-caffeoylquinic acid (neochlorogenic acid) s 16.3 300, 324 353 135, 179, 191 b 355 145, 163 b, 337 1.06 ± 0.20 chlorogenic acid 353, 707
E 3-O-p-coumaroylquinic acid 20.2 314 337 163 b, 173, 290 339 147 b 0.14 ± 0.02 chlorogenic acid 337
F phenolic acid derivative 21.1 288, 326 533 179, 191, 353, 489 b 535 163, 355, 517 b 0.17 ± 0.08 chlorogenic acid 533
G caffeic acid s 22.3 243, 300 sh, 324 179 - 709 355 b, 447, 499, 517, 691 0.27 ± 0.06 chlorogenic acid 179
H caffeoylquinic acid-arginine conjugate I 22.5 280, 325 527 365, 353 b, 191 529 - 0.58 ± 0.14 chlorogenic acid 527
I 5-O-caffeoylquinic acid (chlorogenic acid) s 22.9 245, 300 sh, 325 353 215, 191 b, 173 355 145, 163 b 9.57 ± 1.89 chlorogenic acid 353, 707
J 4-O-caffeoylquinic acid (cryptochlorogenic acid) s 24.7 243, 300 sh, 326 353 173 b, 191 355 117, 163 b 1.30 ± 0.26 chlorogenic acid 353, 707
K caffeoylquinic acid-arginine conjugate II 26.0 280, 324 527 179, 191 b, 353, 489 529 - 0.43 ± 0.02 chlorogenic acid 533
L caffeoylquinic acid-arginine conjugate III 26.7 283, 325 527 353 b, 191 529 - 0.20 ± 0.05 chlorogenic acid 527
M caffeoylquinic acid isomer 27.3 242, 300 sh, 324 353 215, 191 b, 173 353 - 0.15 ± 0.07 chlorogenic acid 353, 707
N undefined compound 28.9 312 439 233, 395 b 441 - 0.12 ± 0.01 chlorogenic acid 439
O caffeoylshikimic acid isomer 30.5 326 335 135, 179 b 337 114, 209, 322 b 0.18 ± 0.03 chlorogenic acid 335
P caffeoylshikimic acid isomer 32.5 240, 324 335 135, 179 b 337 - 0.16 ± 0.02 chlorogenic acid 335
Q dicaffeoylquinic acid ethyl ester isomer 32.7 280, 325 543 353 b, 335, 191 545 - 0.08 ± 0.04 chlorogenic acid 543
R dicaffeoylquinic acid ethyl ester isomer 33.2 280, 324 543 353 b, 289, 191 545 - 0.26 ± 0.13 chlorogenic acid 543
S caffeoylquinic acid ethyl ester isomer 34.1 243, 300 sh, 326 381 135, 161 b, 207, 335 383 - 0.52 ± 0.11 chlorogenic acid 381, 763
T caffeoylshikimic acid isomer 34.5 243, 300 sh, 323 335 135, 179 b 337 0.11 ± 0.01 chlorogenic acid 335
U caffeoylquinic acid ethyl ester isomer 39.7 243, 300 sh, 326 381 161 b, 207, 335 383 163 b, 221 0.56 ± 0.14 chlorogenic acid 381, 763
W caffeoylquinic acid ethyl ester isomer 42.3 243, 300 sh, 326 381 135, 179 b, 191 383 145, 163 b, 221, 365 6.23 ± 0.97 chlorogenic acid 381, 763
X caffeoylquinic acid ethyl ester isomer 45.5 243, 300 sh, 326 381 135, 179 b, 191, 335 383 163b, 221 0.07 ± 0.01 chlorogenic acid 381, 763
Y undefined compound 51.4 370 489 243, 269, 287 b - - 0.15 ± 0.04 chlorogenic acid 489
Z undefined compound 53.5 293, 333 207 - 227 - 0.24 ± 0.06 chlorogenic acid 207

b—base peak (the most abundant ion in the recorded spectrum); s—comparison of retention time with the standard was conducted; sh—shoulder in UV-Vis spectrum.