| SpectraBase Compound ID | K5an5CwEoiv |
|---|---|
| InChI | InChI=1S/C17H22O4/c1-3-4-5-6-7-8-13-9-12-10-14(20-2)11-15(18)16(12)17(19)21-13/h9-11,18H,3-8H2,1-2H3 |
| InChIKey | LGJJYEZJYXOSAQ-UHFFFAOYSA-N |
| Mol Weight | 290.36 g/mol |
| Molecular Formula | C17H22O4 |
| Exact Mass | 290.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hh46Z3qrnno |
|---|---|
| Name | Insignin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.151809184 u |
| Formula | C17H22O4 |
| InChI | InChI=1S/C17H22O4/c1-3-4-5-6-7-8-13-9-12-10-14(20-2)11-15(18)16(12)17(19)21-13/h9-11,18H,3-8H2,1-2H3 |
| InChIKey | LGJJYEZJYXOSAQ-UHFFFAOYSA-N |
| SMILES | C1(C2=C(C=C(C=C2O)OC)C=C(O1)CCCCCCC)=O |