| SpectraBase Compound ID | 7zOSEA5dKWU |
|---|---|
| InChI | InChI=1S/C10H22O2/c1-3-4-5-6-10(12)8-7-9(2)11/h9-12H,3-8H2,1-2H3 |
| InChIKey | WHFBEAHOEDIAOX-UHFFFAOYSA-N |
| Mol Weight | 174.28 g/mol |
| Molecular Formula | C10H22O2 |
| Exact Mass | 174.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1503dwN0yTm |
|---|---|
| Name | Decane-2,5-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.161979946 u |
| Formula | C10H22O2 |
| InChI | InChI=1S/C10H22O2/c1-3-4-5-6-10(12)8-7-9(2)11/h9-12H,3-8H2,1-2H3 |
| InChIKey | WHFBEAHOEDIAOX-UHFFFAOYSA-N |
| Molecular Weight | 174.284 g/mol |
| SMILES | CC(CCC(CCCCC)O)O |