| SpectraBase Compound ID | 8VKvRsZZGmV |
|---|---|
| InChI | InChI=1S/C20H28O4/c1-10(2)11-9-12-13(16(23)14(11)21)20(5)8-6-7-19(3,4)18(20)17(24)15(12)22/h9-10,15,17-18,22,24H,6-8H2,1-5H3 |
| InChIKey | BLFROTSKVQIDEU-UHFFFAOYSA-N |
| Mol Weight | 332.44 g/mol |
| Molecular Formula | C20H28O4 |
| Exact Mass | 332.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4XlnL72ZI3M |
|---|---|
| Name | Salviphlomone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.198759378 u |
| Formula | C20H28O4 |
| InChI | InChI=1S/C20H28O4/c1-10(2)11-9-12-13(16(23)14(11)21)20(5)8-6-7-19(3,4)18(20)17(24)15(12)22/h9-10,15,17-18,22,24H,6-8H2,1-5H3 |
| InChIKey | BLFROTSKVQIDEU-UHFFFAOYSA-N |
| Molecular Weight | 332.440 g/mol |
| SMILES | C12=C(C=C(C(C2=O)=O)C(C)C)C(O)C(C2C1(CCCC2(C)C)C)O |