| SpectraBase Compound ID | G4xcx1T3pRy |
|---|---|
| InChI | InChI=1S/C17H30O3/c1-3-5-7-8-9-10-11-12-13-14-16-20-17(18)19-15-6-4-2/h3,5,7-16H2,1-2H3 |
| InChIKey | QPKGOSCWTKETIL-UHFFFAOYSA-N |
| Mol Weight | 282.42 g/mol |
| Molecular Formula | C17H30O3 |
| Exact Mass | 282.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8lPPDAiNbkU |
|---|---|
| Name | Carbonic acid, but-2-yn-1-yl dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.219494823 u |
| Formula | C17H30O3 |
| InChI | InChI=1S/C17H30O3/c1-3-5-7-8-9-10-11-12-13-14-16-20-17(18)19-15-6-4-2/h3,5,7-16H2,1-2H3 |
| InChIKey | QPKGOSCWTKETIL-UHFFFAOYSA-N |
| SMILES | C(CCOC(OCC#CC)=O)CCCCCCCCC |