| SpectraBase Compound ID | IyuTAITojvh |
|---|---|
| InChI | InChI=1S/C17H22O3/c1-2-3-4-8-11-15-16(12-17(18)20-15)19-13-14-9-6-5-7-10-14/h5-7,9-10,12,15H,2-4,8,11,13H2,1H3 |
| InChIKey | MJXIJNRJVVCZKJ-UHFFFAOYSA-N |
| Mol Weight | 274.36 g/mol |
| Molecular Formula | C17H22O3 |
| Exact Mass | 274.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9rinRwy181B |
|---|---|
| Name | 2-Hexyl-3-phenylmethoxy-2H-furan-5-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.156894565 u |
| Formula | C17H22O3 |
| InChI | InChI=1S/C17H22O3/c1-2-3-4-8-11-15-16(12-17(18)20-15)19-13-14-9-6-5-7-10-14/h5-7,9-10,12,15H,2-4,8,11,13H2,1H3 |
| InChIKey | MJXIJNRJVVCZKJ-UHFFFAOYSA-N |
| Molecular Weight | 274.360 g/mol |
| SMILES | C1(OC(C(=C1)OCC=1C=CC=CC1)CCCCCC)=O |