| SpectraBase Compound ID | Boy7HclCavL |
|---|---|
| InChI | InChI=1S/C18H12S/c1-2-4-17-13(3-1)5-6-15-11-14(7-8-18(15)17)16-9-10-19-12-16/h1-12H |
| InChIKey | RXDSYNOVYNGGHX-UHFFFAOYSA-N |
| Mol Weight | 260.35 g/mol |
| Molecular Formula | C18H12S |
| Exact Mass | 260.065972 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LfTIJA7mpjf |
|---|---|
| Name | 3-(Phenanthren-2-yl)thiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.065971560 u |
| Formula | C18H12S |
| InChI | InChI=1S/C18H12S/c1-2-4-17-13(3-1)5-6-15-11-14(7-8-18(15)17)16-9-10-19-12-16/h1-12H |
| InChIKey | RXDSYNOVYNGGHX-UHFFFAOYSA-N |
| Molecular Weight | 260.354 g/mol |
| SMILES | C1=C2C(=C3C(C=CC=C3)=C1)C=CC(=C2)C1=CSC=C1 |