| SpectraBase Compound ID | FyuVy83sCSa |
|---|---|
| InChI | InChI=1S/C18H18O4/c1-13(19)21-17(15-9-5-3-6-10-15)18(22-14(2)20)16-11-7-4-8-12-16/h3-12,17-18H,1-2H3 |
| InChIKey | YERNEDFODXSYDP-UHFFFAOYSA-N |
| Mol Weight | 298.34 g/mol |
| Molecular Formula | C18H18O4 |
| Exact Mass | 298.120509 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1d9LaO1Pg5C |
|---|---|
| Name | 1,2-Diphenylethylene diacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.120509056 u |
| Formula | C18H18O4 |
| InChI | InChI=1S/C18H18O4/c1-13(19)21-17(15-9-5-3-6-10-15)18(22-14(2)20)16-11-7-4-8-12-16/h3-12,17-18H,1-2H3 |
| InChIKey | YERNEDFODXSYDP-UHFFFAOYSA-N |
| SMILES | C1=C(C(C(OC(C)=O)C2=CC=CC=C2)OC(C)=O)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.945401 |