| SpectraBase Compound ID | LoN1Qg48oLS |
|---|---|
| InChI | InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3,7-8H,1,4-6H2,2H3 |
| InChIKey | RVXLYPSYVXXSQE-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Imhu9tREOZI |
|---|---|
| Name | 6-Hepten-2-ol; hept-1-en-6-ol |
| 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/c1-3-4-5-6-7(2)8/h3,7-8H,1,4-6H2,2H3 |
| InChIKey | RVXLYPSYVXXSQE-UHFFFAOYSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | OC(CCCC=C)C |
| Spectrum/Structure Validation Score (Raman) | 0.95197 |