| SpectraBase Compound ID | GUF0fWo9GPr |
|---|---|
| InChI | InChI=1S/C18H32O2/c1-4-7-8-9-10-11-12-13-14-15-16-20-18(19)17(5-2)6-3/h17H,4-6,9-16H2,1-3H3 |
| InChIKey | IDKXWOVGPIEZLF-UHFFFAOYSA-N |
| Mol Weight | 280.5 g/mol |
| Molecular Formula | C18H32O2 |
| Exact Mass | 280.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8uHvp8lMXNj |
|---|---|
| Name | 2-Ethylbutyric acid, dodec-9-ynyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.240230268 u |
| Formula | C18H32O2 |
| InChI | InChI=1S/C18H32O2/c1-4-7-8-9-10-11-12-13-14-15-16-20-18(19)17(5-2)6-3/h17H,4-6,9-16H2,1-3H3 |
| InChIKey | IDKXWOVGPIEZLF-UHFFFAOYSA-N |
| SMILES | C(C(OCCCCCCCCC#CCC)=O)(CC)CC |