| SpectraBase Compound ID | 8SdeVGG99Sz |
|---|---|
| InChI | InChI=1S/C12H16O7/c1-15-12-9(14)8(13)10-7(18-12)5-17-11(19-10)6-3-2-4-16-6/h2-4,7-14H,5H2,1H3/t7-,8+,9-,10+,11?,12-/m0/s1 |
| InChIKey | MDXJDZDPPSUENG-NSNMCDIISA-N |
| Mol Weight | 272.25 g/mol |
| Molecular Formula | C12H16O7 |
| Exact Mass | 272.089603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8v0cRlFWIZH |
|---|---|
| Name | Methyl-4,6-o-furfurylidene.alpha.D-glucopyranoside |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.089602848 u |
| Formula | C12H16O7 |
| InChI | InChI=1S/C12H16O7/c1-15-12-9(14)8(13)10-7(18-12)5-17-11(19-10)6-3-2-4-16-6/h2-4,7-14H,5H2,1H3/t7-,8+,9-,10+,11?,12-/m0/s1 |
| InChIKey | MDXJDZDPPSUENG-NSNMCDIISA-N |
| SMILES | [C@@]1(OC)(O[C@]2(COC(O[C@]2([C@@]([C@@]1(O)[H])(O)[H])[H])C=1OC=CC1)[H])[H] |