| SpectraBase Compound ID | IuTX7GHQdLn |
|---|---|
| InChI | InChI=1S/C12H14O6/c13-8-6-17-12(10(15)9(8)14)18-11(16)7-4-2-1-3-5-7/h1-5,8-10,12-15H,6H2/t8-,9-,10-,12?/m1/s1 |
| InChIKey | AZRXBZPAPSCDMI-HAFPMESGSA-N |
| Mol Weight | 254.24 g/mol |
| Molecular Formula | C12H14O6 |
| Exact Mass | 254.079038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Hpn06qCB3m |
|---|---|
| Name | D-Ribopyranose 1-o-benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.079038165 u |
| Formula | C12H14O6 |
| InChI | InChI=1S/C12H14O6/c13-8-6-17-12(10(15)9(8)14)18-11(16)7-4-2-1-3-5-7/h1-5,8-10,12-15H,6H2/t8-,9-,10-,12?/m1/s1 |
| InChIKey | AZRXBZPAPSCDMI-HAFPMESGSA-N |
| Molecular Weight | 254.238 g/mol |
| SMILES | [C@@]1(COC([C@@]([C@@]1(O)[H])(O)[H])OC(=O)C1=CC=CC=C1)(O)[H] |