![Spiro[4.5]decane-7,9-dione, 8-thiophen-2-ylmethylene-6,10-dioxa-](/api/spectrum/6jSnTqkjZTk/structure.png?h=300&w=458 "Spiro[4.5]decane-7,9-dione, 8-thiophen-2-ylmethylene-6,10-dioxa-")
| SpectraBase Compound ID | Gxi0P2HdTNw |
|---|---|
| InChI | InChI=1S/C13H12O4S/c14-11-10(8-9-4-3-7-18-9)12(15)17-13(16-11)5-1-2-6-13/h3-4,7-8H,1-2,5-6H2 |
| InChIKey | XAZMOGKBQBAXOO-UHFFFAOYSA-N |
| Mol Weight | 264.29 g/mol |
| Molecular Formula | C13H12O4S |
| Exact Mass | 264.04563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6jSnTqkjZTk |
|---|---|
| Name | Spiro[4.5]decane-7,9-dione, 8-thiophen-2-ylmethylene-6,10-dioxa- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.045630036 u |
| Formula | C13H12O4S |
| InChI | InChI=1S/C13H12O4S/c14-11-10(8-9-4-3-7-18-9)12(15)17-13(16-11)5-1-2-6-13/h3-4,7-8H,1-2,5-6H2 |
| InChIKey | XAZMOGKBQBAXOO-UHFFFAOYSA-N |
| Molecular Weight | 264.295 g/mol |
| SMILES | C1(C(OC2(CCCC2)OC1=O)=O)=CC=1SC=CC1 |