| SpectraBase Compound ID | DDeyaMYDUkd |
|---|---|
| InChI | InChI=1S/C14H12O4/c1-8-11(7-12(15)18-2)14(17)10-6-4-3-5-9(10)13(8)16/h3-6H,7H2,1-2H3 |
| InChIKey | FRDWAHKTGWIBIV-UHFFFAOYSA-N |
| Mol Weight | 244.25 g/mol |
| Molecular Formula | C14H12O4 |
| Exact Mass | 244.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8KFO3wRyVqv |
|---|---|
| Name | Methyl (1,4-dihydro-3-methyl-1,4-dioxo-2-naphthyl)acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.073558862 u |
| Formula | C14H12O4 |
| InChI | InChI=1S/C14H12O4/c1-8-11(7-12(15)18-2)14(17)10-6-4-3-5-9(10)13(8)16/h3-6H,7H2,1-2H3 |
| InChIKey | FRDWAHKTGWIBIV-UHFFFAOYSA-N |
| Molecular Weight | 244.246 g/mol |
| SMILES | C12=C(C(C(=C(C2=O)C)CC(=O)OC)=O)C=CC=C1 |