| SpectraBase Compound ID | JZJx2jN73wg |
|---|---|
| InChI | InChI=1S/C9H20O2/c1-9(8-11)6-4-2-3-5-7-10/h9-11H,2-8H2,1H3 |
| InChIKey | SDQROPCSKIYYAV-UHFFFAOYSA-N |
| Mol Weight | 160.26 g/mol |
| Molecular Formula | C9H20O2 |
| Exact Mass | 160.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JWtObvFHZXl |
|---|---|
| Name | 2-Methyl-1,8-octanediol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.146329882 u |
| Formula | C9H20O2 |
| InChI | InChI=1S/C9H20O2/c1-9(8-11)6-4-2-3-5-7-10/h9-11H,2-8H2,1H3 |
| InChIKey | SDQROPCSKIYYAV-UHFFFAOYSA-N |
| Molecular Weight | 160.257 g/mol |
| SMILES | C(C(CCCCCCO)C)O |