| SpectraBase Compound ID | GluHmQqm63G |
|---|---|
| InChI | InChI=1S/C6H10O/c1-3-4-6(2)5-7/h3-4,7H,1,5H2,2H3/b6-4+ |
| InChIKey | NZJRNQDNEIHNQL-GQCTYLIASA-N |
| Mol Weight | 98.14 g/mol |
| Molecular Formula | C6H10O |
| Exact Mass | 98.073165 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GY4klja1ZqU |
|---|---|
| Name | 2,4-Pentadien-1-ol, 2-methyl-, (E)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 98.073164941 u |
| Formula | C6H10O |
| InChI | InChI=1S/C6H10O/c1-3-4-6(2)5-7/h3-4,7H,1,5H2,2H3/b6-4+ |
| InChIKey | NZJRNQDNEIHNQL-GQCTYLIASA-N |
| Molecular Weight | 98.145 g/mol |
| SMILES | C(\C=C\(CO)C)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952829 |