![1-[(E)-prop-1-enoxy]butane](/api/spectrum/7FBx9NHkMby/structure.png?h=300&w=458 "1-[(E)-prop-1-enoxy]butane")
| SpectraBase Compound ID | IuvIQJFgrHc |
|---|---|
| InChI | InChI=1S/C7H14O/c1-3-5-7-8-6-4-2/h4,6H,3,5,7H2,1-2H3/b6-4+ |
| InChIKey | PNKQANLVRCMVPD-GQCTYLIASA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7FBx9NHkMby |
|---|---|
| Name | 1-[(E)-Prop-1-enoxy]butane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 114.104465070 u |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-3-5-7-8-6-4-2/h4,6H,3,5,7H2,1-2H3/b6-4+ |
| InChIKey | PNKQANLVRCMVPD-GQCTYLIASA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C\C=C\OCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923774 |