![Methyl (5S,6R)-5-acetyl-1,4,5,6-tetrahydro-6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate](/api/spectrum/xpTljkV0Ap/structure.png?h=300&w=458 "Methyl (5S,6R)-5-acetyl-1,4,5,6-tetrahydro-6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate")
| SpectraBase Compound ID | BG3VXuICz5k |
|---|---|
| InChI | InChI=1S/C17H22N2O3/c1-11(20)14-9-10-15(17(21)22-4)18-16(14)12-5-7-13(8-6-12)19(2)3/h5-8,10,14,16,18H,9H2,1-4H3/t14-,16+/m1/s1 |
| InChIKey | YPBKAKCJGJRMGB-ZBFHGGJFSA-N |
| Mol Weight | 302.37 g/mol |
| Molecular Formula | C17H22N2O3 |
| Exact Mass | 302.163043 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | xpTljkV0Ap |
|---|---|
| Name | Methyl (5S,6R)-5-acetyl-1,4,5,6-tetrahydro-6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H22N2O3 |
| InChI | InChI=1S/C17H22N2O3/c1-11(20)14-9-10-15(17(21)22-4)18-16(14)12-5-7-13(8-6-12)19(2)3/h5-8,10,14,16,18H,9H2,1-4H3/t14-,16+/m1/s1 |
| InChIKey | YPBKAKCJGJRMGB-ZBFHGGJFSA-N |
| Molecular Weight | 302.374 g/mol |
| SMILES | N1[C@]([C@](CC=C1C(=O)OC)(C(=O)C)[H])(c1ccc(cc1)N(C)C)[H] |
| SPLASH | splash10-0pi1-1953000000-e5a3fca951bda1a3e29b |
| Source of Spectrum | F-50-13720-3 |
| Synonyms | (2R,3S)-3-acetyl-2-(4-dimethylaminophenyl)-1,2,3,4-tetrahydropyridine-6-carboxylic acid methyl ester Methyl (2R,3S)-2-(4-dimethylaminophenyl)-3-ethanoyl-1,2,3,4-tetrahydropyridine-6-carboxylate Methyl (2R,3S)-3-acetyl-2-(4-dimethylaminophenyl)-1,2,3,4-tetrahydropyridine-6-carboxylate Methyl (5S,6R)-5-acetyl-6-[4-(dimethylamino)phenyl]-1,4,5,6-tetrahydro-2-pyridinecarboxylate Methyl (2R,3S)-3-acetyl-2-[4-(dimethylamino)phenyl]-1,2,3,4-tetrahydropyridine-6-carboxylate Methyl (2R,3S)-2-[4-(dimethylamino)phenyl]-3-ethanoyl-1,2,3,4-tetrahydropyridine-6-carboxylate |
| Wiley ID | 790251 |