SpectraBase Compound ID | Eq6PI9NLTLI |
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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 |
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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 |