![(Z)-5-[(E)-3-(2,6,6-Trimethylcyclohex-2-enyl)allylidene]furan-2(5H)-one](/api/spectrum/JRoFNgb0x8q/structure.png?h=300&w=458 "(Z)-5-[(E)-3-(2,6,6-Trimethylcyclohex-2-enyl)allylidene]furan-2(5H)-one")
| SpectraBase Compound ID | JgVJ9MveRuH |
|---|---|
| InChI | InChI=1S/C16H20O2/c1-12-6-5-11-16(2,3)14(12)8-4-7-13-9-10-15(17)18-13/h4,6-10,14H,5,11H2,1-3H3/b8-4+,13-7+ |
| InChIKey | LYXLWMQNBIARIX-UTAVVSQCSA-N |
| Mol Weight | 244.33 g/mol |
| Molecular Formula | C16H20O2 |
| Exact Mass | 244.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JRoFNgb0x8q |
|---|---|
| Name | (Z)-5-[(E)-3-(2,6,6-Trimethylcyclohex-2-enyl)allylidene]furan-2(5H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.146329882 u |
| Formula | C16H20O2 |
| InChI | InChI=1S/C16H20O2/c1-12-6-5-11-16(2,3)14(12)8-4-7-13-9-10-15(17)18-13/h4,6-10,14H,5,11H2,1-3H3/b8-4+,13-7+ |
| InChIKey | LYXLWMQNBIARIX-UTAVVSQCSA-N |
| Molecular Weight | 244.334 g/mol |
| SMILES | C1(O\C(C=C1)=C/C=C/C1C(=CCCC1(C)C)C)=O |