| SpectraBase Compound ID | 27xLcr4k3XX |
|---|---|
| InChI | InChI=1S/C20H12S/c1-3-7-15-13(5-1)9-11-17-18-12-10-14-6-2-4-8-16(14)20(18)21-19(15)17/h1-12H |
| InChIKey | RHACEINAFSEPBJ-UHFFFAOYSA-N |
| Mol Weight | 284.38 g/mol |
| Molecular Formula | C20H12S |
| Exact Mass | 284.065972 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H9ixjg4fmjK |
|---|---|
| Name | Dinaphtho(1,2-B:2',1'-D)thiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.065971560 u |
| Formula | C20H12S |
| InChI | InChI=1S/C20H12S/c1-3-7-15-13(5-1)9-11-17-18-12-10-14-6-2-4-8-16(14)20(18)21-19(15)17/h1-12H |
| InChIKey | RHACEINAFSEPBJ-UHFFFAOYSA-N |
| SMILES | C12=C(SC3=C2C=CC2=C3C=CC=C2)C2=C(C=C1)C=CC=C2 |