| SpectraBase Compound ID | AkEY5CHcsng |
|---|---|
| InChI | InChI=1S/C18H30O4/c1-2-3-4-5-9-14-21-17(19)12-13-18(20)22-15-16-10-7-6-8-11-16/h7,10,16H,2-6,8-9,11-15H2,1H3 |
| InChIKey | MIJJZTJFUVPXOT-UHFFFAOYSA-N |
| Mol Weight | 310.43 g/mol |
| Molecular Formula | C18H30O4 |
| Exact Mass | 310.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GwqRS0ZkkTb |
|---|---|
| Name | Succinic acid, cyclohex-2-enylmethyl heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.214409442 u |
| Formula | C18H30O4 |
| InChI | InChI=1S/C18H30O4/c1-2-3-4-5-9-14-21-17(19)12-13-18(20)22-15-16-10-7-6-8-11-16/h7,10,16H,2-6,8-9,11-15H2,1H3 |
| InChIKey | MIJJZTJFUVPXOT-UHFFFAOYSA-N |
| SMILES | C(C(OCC1CCCC=C1)=O)CC(OCCCCCCC)=O |