| SpectraBase Compound ID | BkYR0lRbjoL |
|---|---|
| InChI | InChI=1S/C9H14O3/c1-2-3-6-11-7-8-4-5-9(10)12-8/h4-5,8H,2-3,6-7H2,1H3 |
| InChIKey | JDDYZMOMOPISLT-UHFFFAOYSA-N |
| Mol Weight | 170.21 g/mol |
| Molecular Formula | C9H14O3 |
| Exact Mass | 170.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2c8qBcet5R5 |
|---|---|
| Name | 2(5H)-Furanone, 5-(butoxymethyl)-, (.+-.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.094294308 u |
| Formula | C9H14O3 |
| InChI | InChI=1S/C9H14O3/c1-2-3-6-11-7-8-4-5-9(10)12-8/h4-5,8H,2-3,6-7H2,1H3 |
| InChIKey | JDDYZMOMOPISLT-UHFFFAOYSA-N |
| Molecular Weight | 170.208 g/mol |
| SMILES | C1(OC(COCCCC)C=C1)=O |