![(rs)-3-Methyl-4-{[(Z)-prop-1-enyl]oxy}butanal](/api/spectrum/L5YYFbxUaBM/structure.png?h=300&w=458 "(rs)-3-Methyl-4-{[(Z)-prop-1-enyl]oxy}butanal")
| SpectraBase Compound ID | 5BG9wRj8MER |
|---|---|
| InChI | InChI=1S/C8H14O2/c1-3-6-10-7-8(2)4-5-9/h3,5-6,8H,4,7H2,1-2H3/b6-3- |
| InChIKey | QIZUBWDUBOINSA-UTCJRWHESA-N |
| Mol Weight | 142.2 g/mol |
| Molecular Formula | C8H14O2 |
| Exact Mass | 142.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | L5YYFbxUaBM |
|---|---|
| Name | (rs)-3-Methyl-4-{[(Z)-prop-1-enyl]oxy}butanal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.099379689 u |
| Formula | C8H14O2 |
| InChI | InChI=1S/C8H14O2/c1-3-6-10-7-8(2)4-5-9/h3,5-6,8H,4,7H2,1-2H3/b6-3- |
| InChIKey | QIZUBWDUBOINSA-UTCJRWHESA-N |
| Molecular Weight | 142.198 g/mol |
| SMILES | C\C=C/OCC(CC=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967134 |