| SpectraBase Compound ID | 9XD71T45h7X |
|---|---|
| InChI | InChI=1S/C20H16O2/c1-21-19-15-9-5-6-10-16(15)20(22-2)18-14-8-4-3-7-13(14)11-12-17(18)19/h3-12H,1-2H3 |
| InChIKey | PTYJZLYGAHHXDM-UHFFFAOYSA-N |
| Mol Weight | 288.35 g/mol |
| Molecular Formula | C20H16O2 |
| Exact Mass | 288.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3TsskTPF5Tn |
|---|---|
| Name | Benz(A)anthracene, 7,12-dimethoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.115029753 u |
| Formula | C20H16O2 |
| InChI | InChI=1S/C20H16O2/c1-21-19-15-9-5-6-10-16(15)20(22-2)18-14-8-4-3-7-13(14)11-12-17(18)19/h3-12H,1-2H3 |
| InChIKey | PTYJZLYGAHHXDM-UHFFFAOYSA-N |
| SMILES | C1=CC2=C(C=C1)C(=C1C(=C2OC)C=CC2=C1C=CC=C2)OC |