| SpectraBase Compound ID | 2wyDXsBq4LC |
|---|---|
| InChI | InChI=1S/C17H30O4/c1-2-3-4-8-13-20-16(18)11-12-17(19)21-14-15-9-6-5-7-10-15/h15H,2-14H2,1H3 |
| InChIKey | YLOFKTICKYRPCJ-UHFFFAOYSA-N |
| Mol Weight | 298.42 g/mol |
| Molecular Formula | C17H30O4 |
| Exact Mass | 298.214409 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7uVlxzZ7Pee |
|---|---|
| Name | Succinic acid, cyclohexylmethyl hexyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.214409442 u |
| Formula | C17H30O4 |
| InChI | InChI=1S/C17H30O4/c1-2-3-4-8-13-20-16(18)11-12-17(19)21-14-15-9-6-5-7-10-15/h15H,2-14H2,1H3 |
| InChIKey | YLOFKTICKYRPCJ-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC1CCCCC1)=O)(OCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.911641 |