| SpectraBase Compound ID | 2dLMFlOSAqI |
|---|---|
| InChI | InChI=1S/C7H12O4/c1-10-7-3-2-5(9)6(4-8)11-7/h2-3,5-9H,4H2,1H3/t5-,6+,7-/m0/s1 |
| InChIKey | BDSSJXGPGYQORZ-XVMARJQXSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C7H12O4 |
| Exact Mass | 160.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kz1LMeMaEfx |
|---|---|
| Name | (2R,3S,6S)-2-(Hydroxymethyl)-6-methoxy-3,6-dihydro-2H-pyran-3-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.073558862 u |
| Formula | C7H12O4 |
| InChI | InChI=1S/C7H12O4/c1-10-7-3-2-5(9)6(4-8)11-7/h2-3,5-9H,4H2,1H3/t5-,6+,7-/m0/s1 |
| InChIKey | BDSSJXGPGYQORZ-XVMARJQXSA-N |
| Molecular Weight | 160.169 g/mol |
| SMILES | [C@]1(O[C@@](C=C[C@@]1(O)[H])(OC)[H])(CO)[H] |