| SpectraBase Compound ID | HilAGfELUJb |
|---|---|
| InChI | InChI=1S/C21H16O2/c22-20(16-11-5-2-6-12-16)21-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)23-21/h1-14,19,21H |
| InChIKey | HBAKBRVYTPZYGM-UHFFFAOYSA-N |
| Mol Weight | 300.36 g/mol |
| Molecular Formula | C21H16O2 |
| Exact Mass | 300.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bv2CJD0F0U0 |
|---|---|
| Name | Phenyl-2,3-dihydro-3-phenylbenzofuran-2-yl ketone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.115029753 u |
| Formula | C21H16O2 |
| InChI | InChI=1S/C21H16O2/c22-20(16-11-5-2-6-12-16)21-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)23-21/h1-14,19,21H |
| InChIKey | HBAKBRVYTPZYGM-UHFFFAOYSA-N |
| SMILES | C1(OC2=CC=CC=C2C1C1=CC=CC=C1)C(=O)C=1C=CC=CC1 |