| SpectraBase Compound ID | 4NoILckDeoR |
|---|---|
| InChI | InChI=1S/C8H14O/c1-4-6-8(3,9)7-5-2/h4-5,9H,1-2,6-7H2,3H3 |
| InChIKey | WAXJJHZQRWWQIR-UHFFFAOYSA-N |
| Mol Weight | 126.2 g/mol |
| Molecular Formula | C8H14O |
| Exact Mass | 126.104465 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | J4RW0YBUd9u |
|---|---|
| Name | 4-Methyl-1,6-heptadien-4-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 126.104465070 u |
| Formula | C8H14O |
| InChI | InChI=1S/C8H14O/c1-4-6-8(3,9)7-5-2/h4-5,9H,1-2,6-7H2,3H3 |
| InChIKey | WAXJJHZQRWWQIR-UHFFFAOYSA-N |
| Molecular Weight | 126.199 g/mol |
| SMILES | OC(CC=C)(CC=C)C |
| Spectrum/Structure Validation Score (Raman) | 0.953589 |