| SpectraBase Compound ID | DukKbPRsf6F |
|---|---|
| InChI | InChI=1S/C17H26O3/c1-16(2,3)14(18)10-12(13-8-7-9-20-13)11-15(19)17(4,5)6/h7-9,12H,10-11H2,1-6H3 |
| InChIKey | UEKTUJTVGSBPKP-UHFFFAOYSA-N |
| Mol Weight | 278.39 g/mol |
| Molecular Formula | C17H26O3 |
| Exact Mass | 278.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K5ZIvPFm8yL |
|---|---|
| Name | 3,7-Nonanedione, 5-(2-furanyl)-2,2,8,8-tetramethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.188194694 u |
| Formula | C17H26O3 |
| InChI | InChI=1S/C17H26O3/c1-16(2,3)14(18)10-12(13-8-7-9-20-13)11-15(19)17(4,5)6/h7-9,12H,10-11H2,1-6H3 |
| InChIKey | UEKTUJTVGSBPKP-UHFFFAOYSA-N |
| Molecular Weight | 278.392 g/mol |
| SMILES | C=1(C(CC(C(C)(C)C)=O)CC(C(C)(C)C)=O)OC=CC1 |