| SpectraBase Compound ID | 2ndWRgcalz9 |
|---|---|
| InChI | InChI=1S/C28H22O/c29-27(23-15-7-2-8-16-23)21-26(22-13-5-1-6-14-22)28(24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20H,21H2 |
| InChIKey | YULCEOSWQKLADM-UHFFFAOYSA-N |
| Mol Weight | 374.48 g/mol |
| Molecular Formula | C28H22O |
| Exact Mass | 374.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DT95qkKYcvt |
|---|---|
| Name | 3-Buten-1-one, 1,3,4,4-tetraphenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.167065327 u |
| Formula | C28H22O |
| InChI | InChI=1S/C28H22O/c29-27(23-15-7-2-8-16-23)21-26(22-13-5-1-6-14-22)28(24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20H,21H2 |
| InChIKey | YULCEOSWQKLADM-UHFFFAOYSA-N |
| Molecular Weight | 374.483 g/mol |
| SMILES | C(=O)(CC(=C(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1 |