| SpectraBase Compound ID | Cyy1lxf1PjT |
|---|---|
| InChI | InChI=1S/C7H14O/c1-7(2)5-3-4-6-8/h5,8H,3-4,6H2,1-2H3 |
| InChIKey | KXKYVCJJVWNXQR-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LaPufPwtGNp |
|---|---|
| Name | 4-Hexen-1-ol, 5-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 114.104465070 u |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-7(2)5-3-4-6-8/h5,8H,3-4,6H2,1-2H3 |
| InChIKey | KXKYVCJJVWNXQR-UHFFFAOYSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C(=CCCCO)(C)C |