| SpectraBase Compound ID | 8CSSn9l0Pxq |
|---|---|
| InChI | InChI=1S/C17H24O12/c1-8(18)25-7-13(26-9(2)19)14(27-10(3)20)15(28-11(4)21)16(17(23)24-6)29-12(5)22/h13-16H,7H2,1-6H3 |
| InChIKey | VLQXFOZGUZCYFY-UHFFFAOYSA-N |
| Mol Weight | 420.37 g/mol |
| Molecular Formula | C17H24O12 |
| Exact Mass | 420.126776 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7UGzrkIT2SG |
|---|---|
| Name | Gluconic acid ME5AC @P1508 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 420.126776201 u |
| Formula | C17H24O12 |
| InChI | InChI=1S/C17H24O12/c1-8(18)25-7-13(26-9(2)19)14(27-10(3)20)15(28-11(4)21)16(17(23)24-6)29-12(5)22/h13-16H,7H2,1-6H3 |
| InChIKey | VLQXFOZGUZCYFY-UHFFFAOYSA-N |
| Molecular Weight | 420.367 g/mol |
| SMILES | C(C(C(=O)OC)OC(=O)C)(C(C(OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C |