| SpectraBase Compound ID | IdYGmpgjrGC |
|---|---|
| InChI | InChI=1S/C16H12O2/c1-2-10-6-5-9-13-14(10)16(18)12-8-4-3-7-11(12)15(13)17/h3-9H,2H2,1H3 |
| InChIKey | HSKPJQYAHCKJQC-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C16H12O2 |
| Exact Mass | 236.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8zGGRRvNXRf |
|---|---|
| Name | 9,10-Anthracenedione, 1-ethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.083729624 u |
| Formula | C16H12O2 |
| InChI | InChI=1S/C16H12O2/c1-2-10-6-5-9-13-14(10)16(18)12-8-4-3-7-11(12)15(13)17/h3-9H,2H2,1H3 |
| InChIKey | HSKPJQYAHCKJQC-UHFFFAOYSA-N |
| Molecular Weight | 236.270 g/mol |
| SMILES | C1(=O)C2=C(C(C3=C1C=CC=C3)=O)C=CC=C2CC |