| SpectraBase Compound ID | 8pQBHkE1uYT |
|---|---|
| InChI | InChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h5-6,18-20,24-25H,2-4,7-17H2,1H3/b6-5- |
| InChIKey | KDUIMXINOLVPCT-WAYWQWQTSA-N |
| Mol Weight | 346.6 g/mol |
| Molecular Formula | C23H38O2 |
| Exact Mass | 346.28718 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Aurc0GUFaY |
|---|---|
| Name | Mangol ii |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.287180462 u |
| Formula | C23H38O2 |
| InChI | InChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h5-6,18-20,24-25H,2-4,7-17H2,1H3/b6-5- |
| InChIKey | KDUIMXINOLVPCT-WAYWQWQTSA-N |
| Molecular Weight | 346.555 g/mol |
| SMILES | C1(=CC(=CC(=C1)CCCCCCCCCCC\C=C/CCCC)O)O |