| SpectraBase Compound ID | Kqe29hTmOu6 |
|---|---|
| InChI | InChI=1S/2C6H12O7.Ca.H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;/h2*2-5,7-11H,1H2,(H,12,13);;1H2/q;;+2;/p-2/t2*2-,3-,4+,5-;;/m11../s1 |
| InChIKey | XLNFVCRGJZBQGX-XRDLMGPZSA-L |
| Mol Weight | 448.387 g/mol |
| Molecular Formula | C12H24CaO15 |
| Exact Mass | 448.074111 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 56qed0xmy80 |
|---|---|
| Name | D-gluconic acid, calcium salt(2.1), hydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H24CaO15 |
| InChI | InChI=1S/2C6H12O7.Ca.H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;/h2*2-5,7-11H,1H2,(H,12,13);;1H2/q;;+2;/p-2/t2*2-,3-,4+,5-;;/m11../s1 |
| InChIKey | XLNFVCRGJZBQGX-XRDLMGPZSA-L |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 29609M |
| Solvent | D2O/DCl |