| SpectraBase Compound ID | KxHITwbt0JF |
|---|---|
| InChI | InChI=1S/C22H32O4/c1-4-5-6-7-8-9-10-11-12-13-18-14-17-15-19(24-2)16-20(25-3)21(17)22(23)26-18/h14-16H,4-13H2,1-3H3 |
| InChIKey | ALBMEFHKEOBYJA-UHFFFAOYSA-N |
| Mol Weight | 360.5 g/mol |
| Molecular Formula | C22H32O4 |
| Exact Mass | 360.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B8OZDC5bzmU |
|---|---|
| Name | 6,8-Dimethoxy-3-undecyl-2-benzopyran-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.230059506 u |
| Formula | C22H32O4 |
| InChI | InChI=1S/C22H32O4/c1-4-5-6-7-8-9-10-11-12-13-18-14-17-15-19(24-2)16-20(25-3)21(17)22(23)26-18/h14-16H,4-13H2,1-3H3 |
| InChIKey | ALBMEFHKEOBYJA-UHFFFAOYSA-N |
| Molecular Weight | 360.494 g/mol |
| SMILES | C1(C=2C(=CC(=CC2OC)OC)C=C(O1)CCCCCCCCCCC)=O |