| SpectraBase Compound ID | FWBURdMQlrM |
|---|---|
| InChI | InChI=1S/C14H24O4/c1-2-17-13(15)9-5-6-10-14(16)18-11-12-7-3-4-8-12/h12H,2-11H2,1H3 |
| InChIKey | IVWMWVNNCNZZNZ-UHFFFAOYSA-N |
| Mol Weight | 256.34 g/mol |
| Molecular Formula | C14H24O4 |
| Exact Mass | 256.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8fybRX8QOPJ |
|---|---|
| Name | Adipic acid, cyclopentylmethyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.167459249 u |
| Formula | C14H24O4 |
| InChI | InChI=1S/C14H24O4/c1-2-17-13(15)9-5-6-10-14(16)18-11-12-7-3-4-8-12/h12H,2-11H2,1H3 |
| InChIKey | IVWMWVNNCNZZNZ-UHFFFAOYSA-N |
| Molecular Weight | 256.342 g/mol |
| SMILES | C1CC(CC1)COC(=O)CCCCC(OCC)=O |