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D-gluconic acid, calcium salt(2.1), hydrate
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

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