| SpectraBase Compound ID | GOLHvJqLfiu |
|---|---|
| InChI | InChI=1S/C20H23NO4/c1-21-10-9-12-5-7-15(22-2)19-17(12)14(21)11-13-6-8-16(23-3)20(24-4)18(13)25-19/h5-8,14H,9-11H2,1-4H3 |
| InChIKey | WXFLVVMTZWLCTQ-UHFFFAOYSA-N |
| Mol Weight | 341.41 g/mol |
| Molecular Formula | C20H23NO4 |
| Exact Mass | 341.162708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9GCgoEQrzOP |
|---|---|
| Name | Sarcocapnine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 341.162708221 u |
| Formula | C20H23NO4 |
| InChI | InChI=1S/C20H23NO4/c1-21-10-9-12-5-7-15(22-2)19-17(12)14(21)11-13-6-8-16(23-3)20(24-4)18(13)25-19/h5-8,14H,9-11H2,1-4H3 |
| InChIKey | WXFLVVMTZWLCTQ-UHFFFAOYSA-N |
| Molecular Weight | 341.407 g/mol |
| SMILES | C12=C3C(N(C)CCC3=CC=C1OC)CC1=C(O2)C(=C(OC)C=C1)OC |