| SpectraBase Compound ID | BQePoTiXLb8 |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h2,4-5,8H,1,3,6-7H2/b5-4+ |
| InChIKey | JHKUFOOWUVOJDX-SNAWJCMRSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1qkh7e9gPJQ |
|---|---|
| Name | (E)-HEPTA-3,6-DIEN-1-OL |
| Compound Number | 10 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h2,4-5,8H,1,3,6-7H2/b5-4+ |
| InChIKey | JHKUFOOWUVOJDX-SNAWJCMRSA-N |
| Literature Reference | L.CROMBIE,L.J.RAINBOW J.CHEM.SOC.PERKIN-1,673(1994) |
| Solvent | Chloroform-d |
| Technique | APT, DEPT, INEPT |