Skip to main content
. 2022 Feb 1;27(3):975. doi: 10.3390/molecules27030975

Table 1.

Formula, MS and UV data of major phytocannabinoids.

Compound [18] Molecular Formula and Mr [18] [M-H]
[MF1-H]
[MF2-H]
[MF3-H]
[19]
Structure [19] UV-VIS Spectra [18]
Acidic HPLC Systems/
Basic HPLC Systems
1H NMR in Deuterated Chloroform [4,20]
Δ9-THC C21H30O2
314.472
C21H29O2, 313.2173
C16H21O2, 245.1547
C12H15O2, 191.1078
C11H15O22, 179.1067
Inline graphic
R1-C5H11, R2-H, R3-H
Inline graphic
Inline graphic
3.20 (1H, dm, 10.9 Hz) 6.31 (1H, q, 1.6 Hz) 1.68 (3H, s) 2.16 (2H, m) 1.90 (1H, m), 1.40 (m) 1.69 (m) 1.41 (3H, s) 1.09 (3H, s) 6.14 (1H, d, 1.6Hz) 6.27 (1H, d, 1.6 Hz) 2.42 (2H, t, 7.3 Hz, 1.6 Hz), 1.55 (2H, q, 7.8 Hz) 1.29 (m) 1.29 (m) d 0.87 (3H, t, 7.0 Hz) 4.87 (1H, s)
Δ8-THC C21H30O2
314.472
C21H29O2, 313.2173
C16H21O2, 245.1547
C12H15O2, 191.1078
C11H15O2, 179.1067
Inline graphic
-
Inline graphic Inline graphic
THV C19H26O2
286.418
C19H25O2, 285.1860
C14H17O2, 217.1234
C10H11O2, 163.0765
C9H11O2, 151.0765
Inline graphic
R1-C3H17, R2-H, R3-H
-
-
CBD C21H30O2
314.472
C21H29O2, 313.2173
C16H21O2, 245.1547
C12H15O2, 191.1078
C11H15O2, 179.1067
Inline graphic
R1-C5H11, R2-H, R3-H
Inline graphic Inline graphic 3.90 (1H, dm, 11.8Hz) 5.57 (1H, s) 2.21 (1H, m), 2.09 (1H, m) 1.84 (m) 2.40 (m) 1.79 (3H, s) 4.64 (trans, 1H, m), 4.54 (cis, 1H, m) 1.66 (3H, s) 6.26 (1H, brs) 6.16 (1H, brs) 2.43 (2H, t, 7.5Hz) 1.55 (2H, q, 7.6Hz) 1.29 (m) 1.29 (m) 0.88 (3H, t, 6.8Hz) 5.99 (1H, s) 5.02 (1H, s)
CBN C21H26O2
310.440
C21H25O2, 309.1860
C19H19O2, 279.1391
C12H11O2, 171.0815
Inline graphic
R1-C5H11, R2-H, R3-H, R4-H
Inline graphic
Inline graphic
8.16 (1H, s) 2.38 (3H, s) 7.07 (1H, d, 7.9Hz) 7.14 (1H, d, 7.9Hz) 1.60 (6H, s) 1.60 (6H, s) 6.29 (1H, d, 1.1Hz) 6.44 (1H, d, 1.1Hz) 2.50 (2H, t, 7.5Hz) 1.63 (m) 1.32 (m) g 1.32 (m) g 0.89 (3H, t, 6.8Hz)5.13 (1H, s)
CBG C21H32O2
316.488
C21H31O2, 315.2329
C16H21O2, 245.1547
C12H15O2, 191.1078
C11H15O2, 179.1067
Inline graphic
R1-C5H11, R2-H, R3-H, R4-H
Inline graphic
Inline graphic
6.26 (2H, s) d 6. (2H, s) d 3.41 (2H, d, 7.0 Hz) 5.29 (1H, m) 1.82 (3H, s) 2.09 (4H, m) 2.09 (4H, m) 5.07 (1H, m) 1.60 (3H, s) 1.69 (3H, s) 2.45 (2H, t, 7.5 Hz) 1.56 (2H, q, 7.8 Hz) 1.33 (4H, m) 1.33 (4H, m) 0.90 (3H, t, 6.9 Hz) 5.36 (2H, s)
CBC C21H30O2
314.172
C12H29O2, 313.2173
C16H19O2, 243.1391
C12H15O2, 191.1078
C11H15O2, 179.1067
Inline graphic
R1-C5H11, R2-H
Inline graphic
Inline graphic
N/A
CBL C21H30O2
314.472
C21H29O2, 313.2173
C16H19O2, 243.1391
C12H15O2, 191.1078
C11H15O2, 179.1067
graphic file with name molecules-27-00975-i020.jpg N/A N/A
Δ9-THCA C22H30O24
358.482
C22H29O4, 357.2071
C21H30O2, 245.1547
C12H15O2, 191.1078
C11H15O22, 179.1067
Inline graphic
R1-C5H11, R2-COOH, R3-H
Inline graphic
Inline graphic
3.23 (1H, dm, 7.0 Hz), 6.39(1H, brs), 1.68 (3H, s), 2.17 (2H, m) 1.92 (1H, m) 1.35 (m) 1.67 (m) 1.44 (3H, s) 1.11 (3H, s) 6.26 (1H, s) 2.94 (1H, m) 2.78 (1H, m) 1.57 (2H, 1.35 (m) 1.35 (m) 0.90 (3H, t, 6.9 Hz) 12.19 (1H, s)
Δ9-THCA-C4 C21H28O4
344.455
C21H27O4, 343.1915
C15H19O2, 231.1391
C11H13O2, 177.0921
C10H13O2, 165.0921
Inline graphic
R1-C4H9, R2-COOH, R3-H
Inline graphic
Inline graphic
N/A
THVA C20H26O4
330.428
C20H25O4, 329.1758
C14H17O2, 217.1234
C10H11O2, 163.0765
C9H11O2, 151.0765
Inline graphic
R1-C3H7, R2-COOH, R3-H
Inline graphic
Inline graphic
N/A
CBDA C22H30O4
358.482
C22H29O4, 357.2071
C16H2102, 245.1547
C12H1502, 191.1078
C11H1502, 179.1067
Inline graphic
R1-C5H11, R2-COOH, R3-H
Inline graphic
Inline graphic
N/A
CBNA C22H26O4
354.450
C22H25O4, 353.175
C19H1902, 279.1391
C12H1102, 171.0815
C21H2502, 309.1860
Inline graphic
R1-C5H11, R2-COOH, R3-H, R4-H
Inline graphic
Inline graphic
N/A
CBGA C22H32O4
360.498
C22H31O4, 359.2228
C16H21O2, 245.1547
C12H15O2, 191.1078
C11H15O2, 179.1067
Inline graphic
R1-C5H11, R2-COOH, R3-H, R4-H
Inline graphic Inline graphic N/A
CBCA C22H30O4
358.482
C22H29O4, 357.2071
C16H19O2, 243.1391
C12H15O2, 191.1078
C11H15O2, 179.1067
R1-C5H11, R2-COOH,
Inline graphic
Inline graphic
Inline graphic
N/A
CBLA C22H30O4
358.482
-
-
-
-
graphic file with name molecules-27-00975-i042.jpg Inline graphic
Inline graphic
N/A