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L-(+)-HISTIDINE, MONOHYDROCHLORIDE, MONOHYDRATE

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L-(+)-HISTIDINE, MONOHYDROCHLORIDE, MONOHYDRATE
SpectraBase Compound ID CRlUZca3jy8
InChI InChI=1S/2C6H9N3O2.2ClH.2Na.2H2O/c2*7-5(6(10)11)1-4-2-8-3-9-4;;;;;;/h2*2-3,5H,1,7H2,(H,8,9)(H,10,11);2*1H;;;2*1H2/q;;;;2*+1;;/p-2
InChIKey FGCKFFMUHKZFHI-UHFFFAOYSA-L
Mol Weight 463.23 g/mol
Molecular Formula C12H22Cl2N6Na2O6
Exact Mass 462.077326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ImKSUbRzlqS
Name L-(+)-HISTIDINE, MONOHYDROCHLORIDE, MONOHYDRATE
Source of Sample MCB Manufacturing Chemists, Norwood, Ohio
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9N3O2 HCl H2O
InChI InChI=1S/2C6H9N3O2.2ClH.2Na.2H2O/c2*7-5(6(10)11)1-4-2-8-3-9-4;;;;;;/h2*2-3,5H,1,7H2,(H,8,9)(H,10,11);2*1H;;;2*1H2/q;;;;2*+1;;/p-2
InChIKey FGCKFFMUHKZFHI-UHFFFAOYSA-L
Melting Point 254C (dec.)
Molecular Weight 209.63
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms HISTIDINE, L-/plus/-, HYDROCHLORIDE, HYDRATE