| SpectraBase Compound ID | KLjBvhVgXW5 |
|---|---|
| InChI | InChI=1S/C8H16O3/c1-3-10-8(11-4-2)6-5-7-9/h5-6,8-9H,3-4,7H2,1-2H3/b6-5+ |
| InChIKey | SKMOVPLFPBVYIR-AATRIKPKSA-N |
| Mol Weight | 160.21 g/mol |
| Molecular Formula | C8H16O3 |
| Exact Mass | 160.109944 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | A3zWgq1ir4W |
|---|---|
| Name | (E)-4,4-bis(Ethoxy)-2-buten-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.109944372 u |
| Formula | C8H16O3 |
| InChI | InChI=1S/C8H16O3/c1-3-10-8(11-4-2)6-5-7-9/h5-6,8-9H,3-4,7H2,1-2H3/b6-5+ |
| InChIKey | SKMOVPLFPBVYIR-AATRIKPKSA-N |
| Molecular Weight | 160.213 g/mol |
| SMILES | C(\C=C\C(OCC)OCC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.960755 |