| SpectraBase Compound ID | 1uaneizP5NY |
|---|---|
| InChI | InChI=1S/C18H16O6/c1-9-5-12(22-3)16-13(6-9)24-14-8-10(21-2)7-11(18(20)23-4)15(14)17(16)19/h5-8H,1-4H3 |
| InChIKey | BAGKZFFEHOTSMT-UHFFFAOYSA-N |
| Mol Weight | 328.32 g/mol |
| Molecular Formula | C18H16O6 |
| Exact Mass | 328.094688 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 413PbUOHCD0 |
|---|---|
| Name | 4-Hydroxyvertixanthone, dimethyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.094688229 u |
| Formula | C18H16O6 |
| InChI | InChI=1S/C18H16O6/c1-9-5-12(22-3)16-13(6-9)24-14-8-10(21-2)7-11(18(20)23-4)15(14)17(16)19/h5-8H,1-4H3 |
| InChIKey | BAGKZFFEHOTSMT-UHFFFAOYSA-N |
| Molecular Weight | 328.320 g/mol |
| SMILES | C1(C2=C(C=C(C=C2OC2=C1C(=CC(=C2)C)OC)OC)C(=O)OC)=O |