| SpectraBase Compound ID | JqN1jvBFCGT |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-2-3-4-5-6-7-9-12(14)13-10-8-11-15-13/h7-11H,2-6H2,1H3/b9-7+ |
| InChIKey | HGWCJLHNTZAODD-VQHVLOKHSA-N |
| Mol Weight | 206.28 g/mol |
| Molecular Formula | C13H18O2 |
| Exact Mass | 206.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4haxEpzFu2H |
|---|---|
| Name | (E)-1-(2-Furyl)-2-nonen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.130679818 u |
| Formula | C13H18O2 |
| InChI | InChI=1S/C13H18O2/c1-2-3-4-5-6-7-9-12(14)13-10-8-11-15-13/h7-11H,2-6H2,1H3/b9-7+ |
| InChIKey | HGWCJLHNTZAODD-VQHVLOKHSA-N |
| Molecular Weight | 206.285 g/mol |
| SMILES | C=1(C(\C=C\CCCCCC)=O)OC=CC1 |