| SpectraBase Compound ID | 9nPsjgfOeEJ |
|---|---|
| InChI | InChI=1S/C20H22O4/c1-4-13-24-19-8-6-5-7-17(19)18(21)12-10-15-9-11-16(22-2)14-20(15)23-3/h5-12,14H,4,13H2,1-3H3/b12-10+ |
| InChIKey | AGWNATBECZPJGC-ZRDIBKRKSA-N |
| Mol Weight | 326.39 g/mol |
| Molecular Formula | C20H22O4 |
| Exact Mass | 326.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3r4Mdhb0Ryx |
|---|---|
| Name | 2,4-Dimethoxy-2'-(N-propyl)oxychalcone (isomer 2) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.151809184 u |
| Formula | C20H22O4 |
| InChI | InChI=1S/C20H22O4/c1-4-13-24-19-8-6-5-7-17(19)18(21)12-10-15-9-11-16(22-2)14-20(15)23-3/h5-12,14H,4,13H2,1-3H3/b12-10+ |
| InChIKey | AGWNATBECZPJGC-ZRDIBKRKSA-N |
| Molecular Weight | 326.392 g/mol |
| SMILES | C1(=C(C=CC=C1)OCCC)C(\C=C\C=1C=CC(OC)=CC1OC)=O |