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. 2021 Apr 15;69(16):4816–4826. doi: 10.1021/acs.jafc.1c00679

Table 1. Phenolic Compounds in the Regular and Low Alcoholic Craft Beers Analyzed by HPLC-ESI-MS/MS.

peak name tR (min) [M – H] (m/z) [M-174-H] (m/z) [M-162-H] (m/z)
1 unknown 2.87 301    
2 3,4,5-trihydroxybenzoic acid (GA)a 3.04 169    
3 caffeic acid-O-hexoside Ib 3.37     179
4 hydroxy-dimethoxybenzoic acid Ib 3.78 197    
5 hydroxy-methoxybenzoic acid Ib 4.02 167    
6 unknown 4.12 285    
7 sinapic acid-O-hexoside Ib 4.18     223
8 3,5-dihydroxybenzoic acidb 4.21 153    
9 3-caffeoylquinic acidb 4.56 353    
10 ferulic acid-O-hexosideb 4.70     193
11 3,4-dihydroxybenzoic acid (PCA)a 5.00 153    
12 hydroxy-methoxybenzoic acid IIb 5.34 167    
13 coumaric acid-O-hexosideb 5.53     163
14 sinapic acid-O-hexoside IIb 5.96     223
15 2,5-dihydroxybenzoic acid (gentisic acid)b 6.32 153    
16 coumaroylquinic acidb 6.45   163  
17 sinapic acid-O-hexoside IIIb 6.62     223
18 5-caffeoylquinic acid (CQA)a 6.64 353    
19 hydroxy-dimethoxybenzoic acid IIb 6.88 197    
20 trihydroxybenzoic acid Ib 7.19 169    
21 2,6-dihydroxybenzoic acidb 7.24 153    
22 hydroxy-methoxybenzoic acid IIIb 7.25 167    
23 unknown 7.26 137    
24 4-caffeoylquinic acidb 7.33 353    
25 3-feruloylquinic acidb 7.47   193  
26 4-hydroxybenzoic acid (pHBA)a 7.72 137    
27 quercetin hexoside Ib 8.74     301
28 4-hydroxy-3-methoxybenzoic acid (VA)a 9.03 167    
29 hydroxy-dimethoxybenzoic acid IIIb 9.12 197    
30 caffeic acid (CA)a 9.38 179    
31 4-hydroxy-3,5-dimethoxybenzoic acid (SyA)a 9.39 197    
32 quercetin hexoside IIb 9.53     301
33 unknown 9.61 609    
34 hydroxy-dimethoxybenzoic acid IVb 10.71 197    
35 kampferol-3-O-hexosideb 11.31     285
36 4-feruloylquinic acidb 11.62   193  
37 trihydroxybenzoic acid IIb 13.46 169    
38 p-coumaric acid (CuA)a 14.04 163    
39 unknown 14.41 223    
40 unknown 14.89 609    
41 unknown 15.22 609    
42 sinapic acid (SA)a 15.86 223    
43 ferulic acid (FA)a 16.05 193    
44 quercetin-3-O-rutinoside (Ru)a 16.67 609    
45 kampferol-3-O-rutinosideb 17.78     [M-308-H] = 285
46 unknown 17.78 301    
47 2-hydroxybenzoic acid (salycilic acid)b 19.39 137    
48 quercetin (Q)a 27.68 301    
49 kampferol (K)a 30.25 285    
50 isoxanthumolb 32.76 353    
a

Identified by comparison with standard.

b

Tentatively identified.