| SpectraBase Compound ID | FSbSP6Orale |
|---|---|
| InChI | InChI=1S/C21H28O3/c1-3-5-6-7-8-10-15-18-16-24-20(17-13-11-9-12-14-17)19(18)21(22)23-4-2/h9,11-14,16H,3-8,10,15H2,1-2H3 |
| InChIKey | LVELTIFNBJIHBY-UHFFFAOYSA-N |
| Mol Weight | 328.45 g/mol |
| Molecular Formula | C21H28O3 |
| Exact Mass | 328.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DmDRWZm7OBP |
|---|---|
| Name | 2-Phenyl-3-(ethoxycarbonyl)-4-(N-octyl)furan |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.203844759 u |
| Formula | C21H28O3 |
| InChI | InChI=1S/C21H28O3/c1-3-5-6-7-8-10-15-18-16-24-20(17-13-11-9-12-14-17)19(18)21(22)23-4-2/h9,11-14,16H,3-8,10,15H2,1-2H3 |
| InChIKey | LVELTIFNBJIHBY-UHFFFAOYSA-N |
| Molecular Weight | 328.452 g/mol |
| SMILES | C1(=C(OC=C1CCCCCCCC)C=1C=CC=CC1)C(=O)OCC |