beta-D-threo-2,5-Hexodiulo-2,6-pyranosonic acid, 5-hydrate, calcium salt (2:1)

SpectraBase Compound ID	9n95yj8X1h3
InChI	InChI=1S/2C6H10O8.Ca/c27-2-3(8)6(13,4(9)10)14-1-5(2,11)12;/h22-3,7-8,11-13H,1H2,(H,9,10);/q;;+2/p-2
InChIKey	DQCYBPVHIVFKRU-UHFFFAOYSA-L Google Search
Mol Weight	458.34 g/mol
Molecular Formula	C12H18CaO16
Exact Mass	458.022075 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	DGFyy6IVhNO
Name	beta-D-threo-2,5-Hexodiulo-2,6-pyranosonic acid, 5-hydrate, calcium salt (2:1)
CAS Registry Number	73960-88-0
Copyright	Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C12H18CaO16
InChI	InChI=1S/2C6H10O8.Ca/c27-2-3(8)6(13,4(9)10)14-1-5(2,11)12;/h22-3,7-8,11-13H,1H2,(H,9,10);/q;;+2/p-2
InChIKey	DQCYBPVHIVFKRU-UHFFFAOYSA-L
Instrument Name	Bruker IFS 85
Synonyms	2,5-Diketo-gluconic acid, calcium salt
Technique	KBr-Pellet