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trans-(1,2-cyclohexylenedinitrilo)tetraacetic acid

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trans-(1,2-cyclohexylenedinitrilo)tetraacetic acid
SpectraBase Compound ID BjB8Oiqo3Oo
InChI InChI=1S/2C14H22N2O8.4Na/c2*17-11(18)5-15(6-12(19)20)9-3-1-2-4-10(9)16(7-13(21)22)8-14(23)24;;;;/h2*9-10H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24);;;;/q;;4*+1/p-4
InChIKey OMOCDZPKSQEHSN-UHFFFAOYSA-J
Mol Weight 780.59907713 g/mol
Molecular Formula C28H40N4Na4O16
Exact Mass 780.203008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fg2hQxqUets
Name trans-(1,2-CYCLOHEXYLENEDINITRILO)TETRAACETIC ACID
Source of Sample Fluka AG, Buchs, Switzerland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22N2O8
InChI InChI=1S/2C14H22N2O8.4Na/c2*17-11(18)5-15(6-12(19)20)9-3-1-2-4-10(9)16(7-13(21)22)8-14(23)24;;;;/h2*9-10H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24);;;;/q;;4*+1/p-4
InChIKey OMOCDZPKSQEHSN-UHFFFAOYSA-J
Molecular Weight 346.34
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms ACETIC ACID, /1,2-CYCLOHEXYLENEDINITRILO/TETRA-, trans-,