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ASPARTAME;ALPHA-L-ASPARTYL-L-PHENYLALANINE-METHYLESTER;STABLE-CRYSTAL-FORM
SpectraBase Compound ID 9PPbmdNAIGv
InChI InChI=1S/2C14H18N2O5/c2*1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2*2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11+;10-,11-/m10/s1
InChIKey DTJYLKWVEIUUBU-OLVGZEQWSA-N
Mol Weight 588.61 g/mol
Molecular Formula C28H36N4O10
Exact Mass 588.243143 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ggxh153NjLV
Name ASPARTAME;ALPHA-L-ASPARTYL-L-PHENYLALANINE-METHYLESTER;STABLE-CRYSTAL-FORM
Compound Number IIA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36N4O10
InChI InChI=1S/2C14H18N2O5/c2*1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2*2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11+;10-,11-/m10/s1
InChIKey DTJYLKWVEIUUBU-OLVGZEQWSA-N
Literature Reference Author K.EBISAWA,N.NAGASHIMA,K.I.FUKUHARA,S.KUMON,S.I.KISHIMOTO,E.I .SUZUKI,S.YONEDA,H.U
Literature Reference Citation CHEM.PHARM.BULL.,48,708(2000)
Literature Reference DOI 10.1248/cpb.48.708
Molecular Weight 588.615 g/mol
Solvent D2O
Source File Reference UWLU5140