![(E)-5-Butyl-2'-oxotetrahydro[2,3']-bifuranylidene](/api/spectrum/B9g58NFygiJ/structure.png?h=300&w=458 "(E)-5-Butyl-2'-oxotetrahydro[2,3']-bifuranylidene")
| SpectraBase Compound ID | KP6jpD7vmKd |
|---|---|
| InChI | InChI=1S/C12H18O3/c1-2-3-4-9-5-6-11(15-9)10-7-8-14-12(10)13/h9H,2-8H2,1H3/b11-10+ |
| InChIKey | VCNDKZPYMMJFAP-ZHACJKMWSA-N |
| Mol Weight | 210.27 g/mol |
| Molecular Formula | C12H18O3 |
| Exact Mass | 210.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B9g58NFygiJ |
|---|---|
| Name | (E)-5-Butyl-2'-oxotetrahydro[2,3']-bifuranylidene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.125594437 u |
| Formula | C12H18O3 |
| InChI | InChI=1S/C12H18O3/c1-2-3-4-9-5-6-11(15-9)10-7-8-14-12(10)13/h9H,2-8H2,1H3/b11-10+ |
| InChIKey | VCNDKZPYMMJFAP-ZHACJKMWSA-N |
| Molecular Weight | 210.273 g/mol |
| SMILES | C1(O\C(=C\2C(OCC2)=O)CC1)CCCC |