| SpectraBase Compound ID | Eq6PI9NLTLI |
|---|---|
| InChI | InChI=1S/C8H12O3/c1-2-10-8(9)6-7-4-3-5-11-7/h6H,2-5H2,1H3/b7-6+ |
| InChIKey | FWALKMNFOWCSQI-VOTSOKGWSA-N |
| Mol Weight | 156.18 g/mol |
| Molecular Formula | C8H12O3 |
| Exact Mass | 156.078644 g/mol |
| SpectraBase Spectrum ID | 8LQEEvmtdJS |
|---|---|
| Name | 2-(E)-(Ethoxycarbonylmethylidene)-tetrahydrofuran |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.078644243 u |
| Formula | C8H12O3 |
| InChI | InChI=1S/C8H12O3/c1-2-10-8(9)6-7-4-3-5-11-7/h6H,2-5H2,1H3/b7-6+ |
| InChIKey | FWALKMNFOWCSQI-VOTSOKGWSA-N |
| Molecular Weight | 156.181 g/mol |
| SMILES | C1\C(OCC1)=C/C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.801361 |