| SpectraBase Compound ID | EILFw0Opwlq |
|---|---|
| InChI | InChI=1S/C22H38O3/c1-21(23)24-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-25-22(2,3)4/h7,9H,5-6,8,10,12,14-20H2,1-4H3/b9-7+ |
| InChIKey | YQBSKHYVKPGCNR-VQHVLOKHSA-N |
| Mol Weight | 350.5 g/mol |
| Molecular Formula | C22H38O3 |
| Exact Mass | 350.282095 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 16Y6ObRZDgh |
|---|---|
| Name | (E)-16-Tert-butoxyhexadec-6-en-4-ynyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.282095081 u |
| Formula | C22H38O3 |
| InChI | InChI=1S/C22H38O3/c1-21(23)24-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-25-22(2,3)4/h7,9H,5-6,8,10,12,14-20H2,1-4H3/b9-7+ |
| InChIKey | YQBSKHYVKPGCNR-VQHVLOKHSA-N |
| Molecular Weight | 350.543 g/mol |
| SMILES | C(#CCCCOC(=O)C)\C=C\CCCCCCCCCOC(C)(C)C |