For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

CITRIC ACID, CALCIUM SALT (2:3), TETRAHYDRATE

View entire compound with spectra: 1 NMR, and 2 FTIR

CITRIC ACID, CALCIUM SALT (2:3), TETRAHYDRATE
SpectraBase Compound ID FXpCU14bzDK
InChI InChI=1S/2C6H8O7.3Ca.4H2O/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;;4*1H2/q;;3*+2;;;;/p-6
InChIKey LNIZKKFWMDARJV-UHFFFAOYSA-H
Mol Weight 570.493 g/mol
Molecular Formula C12H18Ca3O18
Exact Mass 569.937086 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DHoJXZHsgBd
Name CITRIC ACID, CALCIUM SALT (2:3), TETRAHYDRATE
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 813-94-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Ca3O14 4H2O
InChI InChI=1S/2C6H8O7.3Ca.4H2O/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;;4*1H2/q;;3*+2;;;;/p-6
InChIKey LNIZKKFWMDARJV-UHFFFAOYSA-H
Molecular Weight 570.51
Solvent Deuterium oxide/Deuterium chloride; Reference=Dioxane Spectrometer= Varian CFT-20