| SpectraBase Compound ID | 7hxEAZyCnmG |
|---|---|
| InChI | InChI=1S/C22H18O2/c23-21-16-20(17-10-4-1-5-11-17)22(24-21,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2 |
| InChIKey | JJYXDDLDDNDXIU-UHFFFAOYSA-N |
| Mol Weight | 314.38 g/mol |
| Molecular Formula | C22H18O2 |
| Exact Mass | 314.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G7qh2FcspjJ |
|---|---|
| Name | 4,5,5-Triphenyl-2-oxolanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.130679818 u |
| Formula | C22H18O2 |
| InChI | InChI=1S/C22H18O2/c23-21-16-20(17-10-4-1-5-11-17)22(24-21,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2 |
| InChIKey | JJYXDDLDDNDXIU-UHFFFAOYSA-N |
| SMILES | C1(C(CC(O1)=O)C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1 |