| SpectraBase Compound ID | LCRHwfSXxIN |
|---|---|
| InChI | InChI=1S/C19H18O4/c1-13-12-17(23-14(2)20)9-10-18(13)19(21)11-6-15-4-7-16(22-3)8-5-15/h4-12H,1-3H3/b11-6+ |
| InChIKey | GFUYFPAMLOCSOW-IZZDOVSWSA-N |
| Mol Weight | 310.35 g/mol |
| Molecular Formula | C19H18O4 |
| Exact Mass | 310.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2lwjtsEEN6y |
|---|---|
| Name | 4'-(Acetyl)oxy-4-methoxy-2'-methylchalcone (isomer 2) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.120509056 u |
| Formula | C19H18O4 |
| InChI | InChI=1S/C19H18O4/c1-13-12-17(23-14(2)20)9-10-18(13)19(21)11-6-15-4-7-16(22-3)8-5-15/h4-12H,1-3H3/b11-6+ |
| InChIKey | GFUYFPAMLOCSOW-IZZDOVSWSA-N |
| Molecular Weight | 310.349 g/mol |
| SMILES | C1(=C(C=C(C=C1)OC(C)=O)C)C(\C=C\C=1C=CC(OC)=CC1)=O |