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L-3-phenyl-N-(L-3-phenylalanyl)alanine, sodium salt, hydrated

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L-3-phenyl-N-(L-3-phenylalanyl)alanine, sodium salt, hydrated
SpectraBase Compound ID AZUdhs09try
InChI InChI=1S/C18H20N2O3.Na.H2O/c19-15(11-13-7-3-1-4-8-13)17(21)20-16(18(22)23)12-14-9-5-2-6-10-14;;/h1-10,15-16H,11-12,19H2,(H,20,21)(H,22,23);;1H2/q;+1;/p-1/t15-,16-;;/m0../s1
InChIKey VSMFBMCSVHXFBZ-SXBSVMRRSA-M
Mol Weight 352.366 g/mol
Molecular Formula C18H21N2NaO4
Exact Mass 352.139901 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4HNMONFVok3
Name L-3-phenyl-N-(L-3-phenylalanyl)alanine, sodium salt, hydrated
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 2577-40-4
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O3 xH2O
InChI InChI=1S/C18H20N2O3.Na.H2O/c19-15(11-13-7-3-1-4-8-13)17(21)20-16(18(22)23)12-14-9-5-2-6-10-14;;/h1-10,15-16H,11-12,19H2,(H,20,21)(H,22,23);;1H2/q;+1;/p-1/t15-,16-;;/m0../s1
InChIKey VSMFBMCSVHXFBZ-SXBSVMRRSA-M
Molecular Weight 312.37
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms Alanine, 3-phenyl-N-/L-3-phenyl- alanyl/-, sodium salt, hydrated, L-,