| SpectraBase Compound ID | IXrV6G2Lcvn |
|---|---|
| InChI | InChI=1S/C9H18O3/c1-8(2)11-6-9(3,5-10-4)7-12-8/h5-7H2,1-4H3 |
| InChIKey | FWWFJVWOVDRNMY-UHFFFAOYSA-N |
| Mol Weight | 174.24 g/mol |
| Molecular Formula | C9H18O3 |
| Exact Mass | 174.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BCMv36X2Vb8 |
|---|---|
| Name | 5-Hydroxymethyl-2,2,5-trimethyl-1,3-dioxane, methyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.125594437 u |
| Formula | C9H18O3 |
| InChI | InChI=1S/C9H18O3/c1-8(2)11-6-9(3,5-10-4)7-12-8/h5-7H2,1-4H3 |
| InChIKey | FWWFJVWOVDRNMY-UHFFFAOYSA-N |
| Molecular Weight | 174.240 g/mol |
| SMILES | C1(OCC(CO1)(C)COC)(C)C |