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(S)-2-Aminohexanedioic acid
SpectraBase Compound ID ID6BxCMUHIn
InChI InChI=1S/2C6H11NO4.3Na.2H2O/c2*7-4(6(10)11)2-1-3-5(8)9;;;;;/h2*4H,1-3,7H2,(H,8,9)(H,10,11);;;;2*1H2/q;;3*+1;;/p-3/i/hD3
InChIKey JYMVXBGGRCTACJ-ZRLBSURWSA-K
Mol Weight 427.308 g/mol
Molecular Formula C12H202H3N2Na3O10
Exact Mass 427.123408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LhSftcFw6pc
Name (S)-2-AMINOHEXANEDIOIC ACID
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 1118-90-7
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11NO4
InChI InChI=1S/2C6H11NO4.3Na.2H2O/c2*7-4(6(10)11)2-1-3-5(8)9;;;;;/h2*4H,1-3,7H2,(H,8,9)(H,10,11);;;;2*1H2/q;;3*+1;;/p-3/i/hD3
InChIKey JYMVXBGGRCTACJ-ZRLBSURWSA-K
Melting Point 203-205C (dec.)
Molecular Weight 161.16
Solvent Deuterium oxide/NaOD; Reference=TSP Spectrometer= Bruker AC-300
Synonyms HEXANEDIOIC ACID, 2-AMINO-, L-,