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Phenolic Acids & Alcohols Standard Mixture - 2

TABLE OF COMPOSITION

CAS
Verified Purity
RT
Mass
Comp
91-10-1
96.6%
19.316
154.063
1.0 mM (0.015%)
93-51-6
98.0%
23.677
138.0681
1.0 mM (0.014%)
123-07-9
99.4%
27.196
122.0732
1.0 mM (0.012%)
500-38-9
97.3%
31.410
302.1518
1.0 mM (0.03%)
108-73-6
>99.9%
1.775
126.0317
1.0 mM (0.013%)
108-46-3
>99.9%
4.089
110.0368
1.0 mM (0.011%)
303-07-1
97.4%
7.958
154.0266
1.0 mM (0.015%)
331-39-5
99.4%
9.767
180.0423
1.0 mM (0.018%)
1135-23-5
94.7%
16.586
196.0736
1.0 mM (0.02%)
327-97-9
99.3%
8.998
354.0951
1.0 mM (0.035%)
1948-33-0
97%
166.0994
0.5 mM
Methanol
67-56-1
32.0262
99.817%

ANALYSIS RESULTS

Analysis method
Instrument

Agilent HPLC 1290 Series

UV Detector: Agilent 1260 Infinity II Diode Array

ELSD Detector: 1260 Infinity II Evaporative Light Scattering Detector.

MSD: Agilent 6460C QQQ

Column

InfinityLab Poroshell 120 EC-C18, 2.1 x 150 mm, 1.9 µm, narrow bore LC column

Chromatography method
  A: 0.1% Formic acid in H2O
B: 0.1% Formic acid in Acetonitrile  
Time (min) A (%) B (%) Flow (mL/min)
0 95 5 0.3
2 95 5 0.3
15 88 12 0.3
35 45 55 0.3
36 0 100 0.3
38 0 100 0.3
39 95 5 0.3
40 95 5 0.3
Chromatogram
Note

All signals in the above chromatogram are recorded at 220nM.

Note

A peak at 13.7 belongs to 0.5mM TBHQ (tert-butylhydroquinone, CAS# 1948-33-0) which is used as an internal standard. The TBHQ in all solutions comes from the same stock mix and is comparable ampule to ampule.

MS Spectra
To view the spectra

Please refer to the online version of the Certificate of Analysis by scanning the QR code on the product label. Click on the name of the corresponding compound in the Sec 3. Table of composition to view the compound specification.

STABILITY

Shelf life and storage
Shelf-life

A shelf life of at least 2 years has been established for this product. 

Your product expires no eariler than Feb 2025

Real-time Stability Test

No data is available at this moment. For the latest stability results, please visit our website (www.metasci.ca)

Additional Methods

MS2 Transitions for MS/MS
Instrument

Agilent QQQ 6460C - ESI

Column

InfinityLab Poroshell 120 EC-C18, 2.1 x 150 mm, 1.9 µm, narrow bore LC column

Analysis Method
  Name Polarity Exact Mass CAS# Fragmentor Precursor Ion Product Ion CE CAV Abundance
1 Syringol Negative 154.063 91-10-1 88 153.1 138 10 4 1489
2 4-Methylguaiacol Negative 138.0681 93-51-6 100 137.1 93.1 10 4 1402
2 4-Methylguaiacol Positive 138.0681 93-51-6 60 161.1 97 14 4 712
2 4-Methylguaiacol Positive 138.0681 93-51-6 60 161.1 85 10 4 743
3 4-Ethylphenol Negative 122.0732 123-07-9 200 121.1 65.1 10 4 989
3 4-Ethylphenol Positive 122.0732 123-07-9 76 145.1 85 2 4 1537
4 Nordihydroguaiaretic Acid Negative 302.1518 500-38-9 88 301.1 122.1 30 4 24288
4 Nordihydroguaiaretic Acid Negative 302.1518 500-38-9 88 301.1 108.1 30 4 3436
5 Phloroglucinol Negative 126.0317 108-73-6 79 125 41.2 38 4 893
5 Phloroglucinol Negative 126.0317 108-73-6 76 125 57.2 14 4 1740
5 Phloroglucinol Positive 126.0317 108-73-6 36 149 85 10 4 7459
5 Phloroglucinol Negative 126.0317 108-73-6 79 125 57.2 14 4 3053
6 Resorcinol Negative 110.0368 108-46-3 88 109 65.2 10 4 2903
6 Resorcinol Negative 110.0368 108-46-3 88 109 67.1 10 4 950
6 Resorcinol Positive 110.0368 108-46-3 110 111.1 65.2 22 4 11276
6 Resorcinol Positive 110.0368 108-46-3 110 111.1 93.1 14 4 7004
7 2,6-Dihydroxybenzoic acid Negative 154.0266 303-07-1 100 153 109.1 14 4 28624
7 2,6-Dihydroxybenzoic acid Negative 154.0266 303-07-1 100 153 135 10 4 10051
8 Caffeic acid Negative 180.0423 331-39-5 137 179 135.1 14 4 62154
8 Caffeic acid Negative 180.0423 331-39-5 137 179 104.9 26 4 66
8 Caffeic acid Negative 180.0423 331-39-5 137 179 120.8 34 4 58
8 Caffeic acid Negative 180.0423 331-39-5 104 179 135.1 10 4 15259
9 Hydroferulic acid Negative 196.0736 1135-23-5 122 195.1 136.1 10 4 6883
9 Hydroferulic acid Negative 196.0736 1135-23-5 122 195.1 121.1 26 4 2955
9 Hydroferulic acid Positive 196.0736 1135-23-5 54 197.1 137.1 10 4 2381
9 Hydroferulic acid Positive 196.0736 1135-23-5 54 197.1 127 10 4 75
10 Chlorogenic acid Negative 354.0951 327-97-9 104 353.1 191.1 14 4 14110
10 Chlorogenic acid Negative 354.0951 327-97-9 104 353.1 85.1 50 4 1522
10 Chlorogenic acid Positive 354.0951 327-97-9 100 355.1 163.1 10 4 14833
10 Chlorogenic acid Positive 354.0951 327-97-9 100 355.1 89.1 60 4 4651
*CE: Collision energy **CAV: Capillary Accelerator Voltage
Notes

- Solvent system used (refer to the ANALYSIS RESULTS -> Chromatography method):

A: 0.1% Formic acid in H2O

B: 0.1% Formic acid in Acetonitrile

- Experimental: Adding 10-100mM ammonium formate to the solvent system may increase the ionization and the signal of the analytes

- Depending on the ion source and the instrument setup, alcohols generally yield lower signal and fragmentation. In such a case, higher injection volume may improve the signal. When the ionization is too week, the sodium adduct (M+Na) is more prominent.

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