| SpectraBase Compound ID | HQ7QRwQlPCi |
|---|---|
| InChI | InChI=1S/C14H22O5/c1-3-18-13(16)11(14(17)19-4-2)12(15)10-8-6-5-7-9-10/h10-11H,3-9H2,1-2H3 |
| InChIKey | PUKYUTOOEYNWAW-UHFFFAOYSA-N |
| Mol Weight | 270.32 g/mol |
| Molecular Formula | C14H22O5 |
| Exact Mass | 270.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BxsXFQS7Uoi |
|---|---|
| Name | Propanedioic acid, (cyclohexylcarbonyl)-, diethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.146723803 u |
| Formula | C14H22O5 |
| InChI | InChI=1S/C14H22O5/c1-3-18-13(16)11(14(17)19-4-2)12(15)10-8-6-5-7-9-10/h10-11H,3-9H2,1-2H3 |
| InChIKey | PUKYUTOOEYNWAW-UHFFFAOYSA-N |
| SMILES | C1C(CCCC1)C(C(C(OCC)=O)C(OCC)=O)=O |