| SpectraBase Compound ID | IhFdrGdD8qn |
|---|---|
| InChI | InChI=1S/C18H20O3/c1-13(19)18(2,14-5-9-16(20-3)10-6-14)15-7-11-17(21-4)12-8-15/h5-12H,1-4H3 |
| InChIKey | FPKVRENXFSRMAD-UHFFFAOYSA-N |
| Mol Weight | 284.36 g/mol |
| Molecular Formula | C18H20O3 |
| Exact Mass | 284.141245 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | i68LSsgasK |
|---|---|
| Name | 2-Butanone, 3,3-bis(4-methoxyphenyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.141244501 u |
| Formula | C18H20O3 |
| InChI | InChI=1S/C18H20O3/c1-13(19)18(2,14-5-9-16(20-3)10-6-14)15-7-11-17(21-4)12-8-15/h5-12H,1-4H3 |
| InChIKey | FPKVRENXFSRMAD-UHFFFAOYSA-N |
| SMILES | C(C(=O)C)(C1=CC=C(C=C1)OC)(C=1C=CC(=CC1)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909762 |