| SpectraBase Compound ID | 76bv9juIa3l |
|---|---|
| InChI | InChI=1S/C10H16O3/c1-7(2)5-8(11)6-9-3-4-10(12)13-9/h7,9H,3-6H2,1-2H3 |
| InChIKey | FCYATEPPYJJCKQ-UHFFFAOYSA-N |
| Mol Weight | 184.23 g/mol |
| Molecular Formula | C10H16O3 |
| Exact Mass | 184.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8z4XHkMHrpH |
|---|---|
| Name | 4-Hydroxy-8-methyl-6-oxononanoic acid, gamma-lactone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.109944372 u |
| Formula | C10H16O3 |
| InChI | InChI=1S/C10H16O3/c1-7(2)5-8(11)6-9-3-4-10(12)13-9/h7,9H,3-6H2,1-2H3 |
| InChIKey | FCYATEPPYJJCKQ-UHFFFAOYSA-N |
| Molecular Weight | 184.235 g/mol |
| SMILES | C1CC(OC1CC(CC(C)C)=O)=O |