| SpectraBase Compound ID | DaZn0JVILUn |
|---|---|
| InChI | InChI=1S/C18H24O4Si/c1-12(2)16(22-23(4,5)6)11-14-15(20-3)9-7-13-8-10-17(19)21-18(13)14/h7-10,16H,1,11H2,2-6H3/t16-/m0/s1 |
| InChIKey | YRZVFHPAUJROHQ-INIZCTEOSA-N |
| Mol Weight | 332.47 g/mol |
| Molecular Formula | C18H24O4Si |
| Exact Mass | 332.144386 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1CvgN9xo13e |
|---|---|
| Name | Auraptenol, tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.144385784 u |
| Formula | C18H24O4Si |
| InChI | InChI=1S/C18H24O4Si/c1-12(2)16(22-23(4,5)6)11-14-15(20-3)9-7-13-8-10-17(19)21-18(13)14/h7-10,16H,1,11H2,2-6H3/t16-/m0/s1 |
| InChIKey | YRZVFHPAUJROHQ-INIZCTEOSA-N |
| Molecular Weight | 332.471 g/mol |
| SMILES | C1(C=CC2=C(O1)C(=C(C=C2)OC)C[C@@](C(=C)C)(O[Si](C)(C)C)[H])=O |