![cis-1-Oxaspiro[4.5]decan-2,8-dion, 6-carbomethoxy-](/api/spectrum/IRAGmiOSR6j/structure.png?h=300&w=458 "cis-1-Oxaspiro[4.5]decan-2,8-dion, 6-carbomethoxy-")
| SpectraBase Compound ID | 6OYkNEf3xEk |
|---|---|
| InChI | InChI=1S/C9H14O3.C2H4O2/c10-8-4-1-7(2-5-8)3-6-9(11)12;1-4-2-3/h7H,1-6H2,(H,11,12);2H,1H3 |
| InChIKey | VJUXWERVVRIKGE-UHFFFAOYSA-N |
| Mol Weight | 230.26 g/mol |
| Molecular Formula | C11H18O5 |
| Exact Mass | 230.115424 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IRAGmiOSR6j |
|---|---|
| Name | cis-1-Oxaspiro[4.5]decan-2,8-dion, 6-carbomethoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.115423675 u |
| Formula | C11H18O5 |
| InChI | InChI=1S/C9H14O3.C2H4O2/c10-8-4-1-7(2-5-8)3-6-9(11)12;1-4-2-3/h7H,1-6H2,(H,11,12);2H,1H3 |
| InChIKey | VJUXWERVVRIKGE-UHFFFAOYSA-N |
| Molecular Weight | 230.260 g/mol |
| Nominal Mass | 230 u |
| SMILES | C(OC)=O.OC(=O)CCC1CCC(CC1)=O |