![1,4-Dioxaspiro[4.4]nonane-7-carboxylic acid, methyl ester](/api/spectrum/KSyaTOgnYRu/structure.png?h=300&w=458 "1,4-Dioxaspiro[4.4]nonane-7-carboxylic acid, methyl ester")
| SpectraBase Compound ID | CJG2VTq1BJr |
|---|---|
| InChI | InChI=1S/C9H14O4/c1-11-8(10)7-2-3-9(6-7)12-4-5-13-9/h7H,2-6H2,1H3 |
| InChIKey | SHKWYHRBZOUPEB-UHFFFAOYSA-N |
| Mol Weight | 186.21 g/mol |
| Molecular Formula | C9H14O4 |
| Exact Mass | 186.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KSyaTOgnYRu |
|---|---|
| Name | 1,4-Dioxaspiro[4.4]nonane-7-carboxylic acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.089208927 u |
| Formula | C9H14O4 |
| InChI | InChI=1S/C9H14O4/c1-11-8(10)7-2-3-9(6-7)12-4-5-13-9/h7H,2-6H2,1H3 |
| InChIKey | SHKWYHRBZOUPEB-UHFFFAOYSA-N |
| Molecular Weight | 186.207 g/mol |
| SMILES | C(=O)(C1CCC2(C1)OCCO2)OC |