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2-Keto-D-gluconic acid hemicalcium salt dihydrate

View entire compound with spectra: 1 FTIR

2-Keto-D-gluconic acid hemicalcium salt dihydrate
SpectraBase Compound ID Gm24kwqFqZR
InChI InChI=1S/2C6H10O7.Ca.2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;;/h2*2-4,7-10H,1H2,(H,12,13);;;/q;;+2;;/p-2/t2*2-,3-,4+;;;/m11.../s1
InChIKey MXDSTRQTFMTYDS-KJIPWXGKSA-L
Mol Weight 458.338 g/mol
Molecular Formula C12H18CaO16
Exact Mass 458.022075 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 70NQ7rsyUz7
Name 2-Keto-D-gluconic acid hemicalcium salt dihydrate
Source of Sample Aldrich
Catalog Number 286389
CAS Registry Number 304655-85-4
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O14*2H2O
InChI InChI=1S/2C6H10O7.Ca.2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;;/h2*2-4,7-10H,1H2,(H,12,13);;;/q;;+2;;/p-2/t2*2-,3-,4+;;;/m11.../s1
InChIKey MXDSTRQTFMTYDS-KJIPWXGKSA-L
Purity 98%
Synonyms D-Arabino-2-hexulopyranosonic acid hemicalcium salt dihydrate
Wiley ID SIAL_ATR-IR_014083