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2-HYDROXYETHANAMINIUM-HYDROGEN-[1-BENZYLOXY-3-(4-METHYLBENZYL)-2,5-DIOXOPYRROLIDIN-3-YL]-PHOSPHONATE
SpectraBase Compound ID DDDlEocgy3Q
InChI InChI=1S/C19H20NO6P.C2H7NO/c1-14-7-9-15(10-8-14)11-19(27(23,24)25)12-17(21)20(18(19)22)26-13-16-5-3-2-4-6-16;3-1-2-4/h2-10H,11-13H2,1H3,(H2,23,24,25);4H,1-3H2
InChIKey QODAJDIJHWSMKJ-UHFFFAOYSA-N
Mol Weight 450.43 g/mol
Molecular Formula C21H27N2O7P
Exact Mass 450.155588 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9PMfSF00UbT
Name 2-HYDROXYETHANAMINIUM-HYDROGEN-[1-BENZYLOXY-3-(4-METHYLBENZYL)-2,5-DIOXOPYRROLIDIN-3-YL]-PHOSPHONATE
Compound Number 8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26N2O7P
InChI InChI=1S/C19H20NO6P.C2H7NO/c1-14-7-9-15(10-8-14)11-19(27(23,24)25)12-17(21)20(18(19)22)26-13-16-5-3-2-4-6-16;3-1-2-4/h2-10H,11-13H2,1H3,(H2,23,24,25);4H,1-3H2
InChIKey QODAJDIJHWSMKJ-UHFFFAOYSA-N
Literature Reference Author W.OWOTOKI,D.GEFFKEN,T.KURZ
Literature Reference Citation AUSTR.J.CHEM.,59,283(2006)
Literature Reference DOI 10.1071/CH06058
Molecular Weight 449.420 g/mol
Sample ID 37865
Solvent D2O