| SpectraBase Compound ID | 4lRgCfcDrBo |
|---|---|
| InChI | InChI=1S/C12H16O5/c1-16-11(14)9(12(15)17-2)7-8-5-3-4-6-10(8)13/h5,9H,3-4,6-7H2,1-2H3 |
| InChIKey | FPDNTFDVVKMRPX-UHFFFAOYSA-N |
| Mol Weight | 240.25 g/mol |
| Molecular Formula | C12H16O5 |
| Exact Mass | 240.099774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G7BvsPobFnk |
|---|---|
| Name | 2-(Cyclohex-2-en-1-on-2-yl-methyl)-malonic acid, dimethyl ester |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H16O5 |
| InChI | InChI=1S/C12H16O5/c1-16-11(14)9(12(15)17-2)7-8-5-3-4-6-10(8)13/h5,9H,3-4,6-7H2,1-2H3 |
| InChIKey | FPDNTFDVVKMRPX-UHFFFAOYSA-N |
| Literature Reference | R. Tamura, H. Katayama, K. Watabe, Tetrahedron 46, 7557 (1990). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |