HuagongsheHuagongshe Chemistry Print Report · For research reference only
alpha-Methylhydrocinnamic acid → HCID 46213051, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | alpha-Methylhydrocinnamic acid | HCID 99862 | — |
| Reactant | (S)-2-Phenylbutyric acid | HCID 785329 | — |
| Reactant | (3aS,4R,6aR)-2-benzyloctahydrocyclopenta[c]pyrrol-4-amine | HCID 25918977 | — |
| Product | HCID 46213051 | HCID 46213051 | — |
Reaction Steps
The title compound was prepared by substituting (3aR,4S,6aS)-2-benzyloctahydrocyclopenta[c]pyrrol-4-amine from Step A of Example 33 for (3aS,4R,6aR)-2-benzyloctahydrocyclopenta[c]pyrrol-4-amine and 2-methyl-3-phenylpropanoic acid for (S)-2-phenylbutanoic acid in Step F of the procedure used to prepare Example 16: 1H NMR (400 MHz, pyridine-d5) δ ppm 8.13 (dd, J=7.0, 21.3, 1H), 7.40 (ddd, J=7.5, 15.5, 25.3, 4H), 7.31-7.22 (m, 6H), 4.42-4.27 (m, 1H), 3.58 (dd, J=6.6, 13.1, 1H), 3.45 (dd, J=13.1, 21.0, 1H), 3.25-3.15 (m, 1H), 2.81-2.67 (m, 3H), 2.49-2.19 (m, 5H), 2.04 (ddd, J=6.0, 12.1, 24.6, 1H), 1.82-1.64 (m, 1H), 1.57-1.40 (m, 1H), 1.40-1.30 (m, 1H), 1.28 (d, J=6.4, 3H); MS (ESI+) m/z 363 (M+H)+.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08691865B2 |
| Source dataset | uspto-grants-2014_04 |
| ORD ID | ord-f9af37ea9c0b4392a75ef4466ac4dca5 |
| Source note | uspto-grants-2014_04 |