| SpectraBase Compound ID | HLW8XJsJNMX |
|---|---|
| InChI | InChI=1S/C9H16O/c1-3-5-7-9-10-8-6-4-2/h3,7,9H,1,4-6,8H2,2H3/b9-7+ |
| InChIKey | LTSXWRCFKJDITI-VQHVLOKHSA-N |
| Mol Weight | 140.23 g/mol |
| Molecular Formula | C9H16O |
| Exact Mass | 140.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4YL5qxk7Al |
|---|---|
| Name | 1-Butyloxy-1,4-pentadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.120115134 u |
| Formula | C9H16O |
| InChI | InChI=1S/C9H16O/c1-3-5-7-9-10-8-6-4-2/h3,7,9H,1,4-6,8H2,2H3/b9-7+ |
| InChIKey | LTSXWRCFKJDITI-VQHVLOKHSA-N |
| Molecular Weight | 140.226 g/mol |
| SMILES | C(\C=C\OCCCC)C=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.988213 |