| SpectraBase Compound ID | K66x0CG4wS8 |
|---|---|
| InChI | InChI=1S/C8H16O/c1-5-6-7(9)8(2,3)4/h5,7,9H,1,6H2,2-4H3/t7-/m0/s1 |
| InChIKey | PXYGGMCZALUAQW-ZETCQYMHSA-N |
| Mol Weight | 128.21 g/mol |
| Molecular Formula | C8H16O |
| Exact Mass | 128.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GemvVDIJ5NM |
|---|---|
| Name | (3S)-2,2-Dimethyl-5-hexen-3-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 128.120115134 u |
| Formula | C8H16O |
| InChI | InChI=1S/C8H16O/c1-5-6-7(9)8(2,3)4/h5,7,9H,1,6H2,2-4H3/t7-/m0/s1 |
| InChIKey | PXYGGMCZALUAQW-ZETCQYMHSA-N |
| Molecular Weight | 128.215 g/mol |
| SMILES | C([C@@](O)(CC=C)[H])(C)(C)C |