| SpectraBase Compound ID | EGRLEl3nGNu |
|---|---|
| InChI | InChI=1S/C18H30O4/c1-3-5-6-7-8-9-12-16-22-18(20)14-11-10-13-17(19)21-15-4-2/h2H,3,5-16H2,1H3 |
| InChIKey | HBXZLDMUHPOLTD-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 | 6ktqQrDC4Ov |
|---|---|
| Name | Adipic acid, nonyl propargyl 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/c1-3-5-6-7-8-9-12-16-22-18(20)14-11-10-13-17(19)21-15-4-2/h2H,3,5-16H2,1H3 |
| InChIKey | HBXZLDMUHPOLTD-UHFFFAOYSA-N |
| SMILES | C(C(=O)OCC#C)CCCC(OCCCCCCCCC)=O |