| SpectraBase Compound ID | Ddt1r9FTeyJ |
|---|---|
| InChI | InChI=1S/C19H18O6/c1-22-9-10-5-12-16(14(6-10)24-3)19(21)17-13(18(12)20)7-11(23-2)8-15(17)25-4/h5-8H,9H2,1-4H3 |
| InChIKey | ISYPZGMUDQFEHX-UHFFFAOYSA-N |
| Mol Weight | 342.35 g/mol |
| Molecular Formula | C19H18O6 |
| Exact Mass | 342.110338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7fOhsDl0cha |
|---|---|
| Name | Citreorosein, tetramethyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.110338294 u |
| Formula | C19H18O6 |
| InChI | InChI=1S/C19H18O6/c1-22-9-10-5-12-16(14(6-10)24-3)19(21)17-13(18(12)20)7-11(23-2)8-15(17)25-4/h5-8H,9H2,1-4H3 |
| InChIKey | ISYPZGMUDQFEHX-UHFFFAOYSA-N |
| Molecular Weight | 342.347 g/mol |
| SMILES | COC1=C2C(=O)C=3C(OC)=CC(COC)=CC3C(=O)C2=CC(OC)=C1 |