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choline dihydrogen citrate

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

choline dihydrogen citrate
SpectraBase Compound ID FOX4vtTzGcJ
InChI InChI=1S/C6H8O7.C5H14NO/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-6(2,3)4-5-7/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);7H,4-5H2,1-3H3/q;+1/p-1
InChIKey WRPUOFKIGGWQIJ-UHFFFAOYSA-M
Mol Weight 295.29 g/mol
Molecular Formula C11H21NO8
Exact Mass 295.126717 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IS5tckMzET1
Name CHOLINE DIHYDROGEN CITRATE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H21NO8
InChI InChI=1S/C6H8O7.C5H14NO/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-6(2,3)4-5-7/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);7H,4-5H2,1-3H3/q;+1/p-1
InChIKey WRPUOFKIGGWQIJ-UHFFFAOYSA-M
Melting Point 105-107.5C
Molecular Weight 295.29
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms CHOLINE CITRATE /1 TO 1/ AMMONIUM DIHYDROGEN CITRATE, /2-HYDROXYETHYL/TRIMETHYL-,