| SpectraBase Compound ID | 2CjCTL6XKwi |
|---|---|
| InChI | InChI=1S/C17H14O2/c18-17-15(11-13-7-3-1-4-8-13)16(12-19-17)14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIKey | KJGOARVXLMFYCA-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C17H14O2 |
| Exact Mass | 250.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8WUe5bO4Xh |
|---|---|
| Name | 4-Phenyl-3-(phenylmethyl)-2(5H)-furanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.099379689 u |
| Formula | C17H14O2 |
| InChI | InChI=1S/C17H14O2/c18-17-15(11-13-7-3-1-4-8-13)16(12-19-17)14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIKey | KJGOARVXLMFYCA-UHFFFAOYSA-N |
| Molecular Weight | 250.297 g/mol |
| SMILES | C1(OCC(=C1CC1=CC=CC=C1)C1=CC=CC=C1)=O |