| SpectraBase Compound ID | 8wtm06ruueq |
|---|---|
| InChI | InChI=1S/C17H22O6/c1-5-6-14-7-8-16(17(9-14)20-4)22-11-15(23-13(3)19)10-21-12(2)18/h5,7-9,15H,1,6,10-11H2,2-4H3 |
| InChIKey | IEPNMPBUURKJHO-UHFFFAOYSA-N |
| Mol Weight | 322.36 g/mol |
| Molecular Formula | C17H22O6 |
| Exact Mass | 322.141638 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G3lEv7KVv3u |
|---|---|
| Name | 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol, diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.141638422 u |
| Formula | C17H22O6 |
| InChI | InChI=1S/C17H22O6/c1-5-6-14-7-8-16(17(9-14)20-4)22-11-15(23-13(3)19)10-21-12(2)18/h5,7-9,15H,1,6,10-11H2,2-4H3 |
| InChIKey | IEPNMPBUURKJHO-UHFFFAOYSA-N |
| Molecular Weight | 322.357 g/mol |
| SMILES | C(OC1=C(C=C(C=C1)CC=C)OC)C(OC(=O)C)COC(C)=O |