| SpectraBase Compound ID | 3kgRjoz7uKY |
|---|---|
| InChI | InChI=1S/C18H14O7/c19-11-3-1-10(5-12(11)20)18(22)16-8-23-14-7-13-9(6-15(14)24-16)2-4-17(21)25-13/h1-7,16,18-20,22H,8H2 |
| InChIKey | ZHXRTJYHLGJEEE-UHFFFAOYSA-N |
| Mol Weight | 342.3 g/mol |
| Molecular Formula | C18H14O7 |
| Exact Mass | 342.073953 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KpelcFKspbb |
|---|---|
| Name | Maoyancaosu |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.073952784 u |
| Formula | C18H14O7 |
| InChI | InChI=1S/C18H14O7/c19-11-3-1-10(5-12(11)20)18(22)16-8-23-14-7-13-9(6-15(14)24-16)2-4-17(21)25-13/h1-7,16,18-20,22H,8H2 |
| InChIKey | ZHXRTJYHLGJEEE-UHFFFAOYSA-N |
| Molecular Weight | 342.303 g/mol |
| SMILES | C1=CC(=O)OC2=CC3=C(C=C12)OC(CO3)C(C=1C=CC(=C(C1)O)O)O |