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(S)-N,N'-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-5-(2-hydroxypropionamido)-2,4,6-triiodoisophthalamide

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(S)-N,N'-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-5-(2-hydroxypropionamido)-2,4,6-triiodoisophthalamide
SpectraBase Compound ID Eam1CU7zl0D
InChI InChI=1S/C17H22I3N3O8/c1-6(28)15(29)23-14-12(19)9(16(30)21-7(2-24)3-25)11(18)10(13(14)20)17(31)22-8(4-26)5-27/h6-8,24-28H,2-5H2,1H3,(H,21,30)(H,22,31)(H,23,29)
InChIKey XQZXYNRDCRIARQ-UHFFFAOYSA-N
Mol Weight 777.09 g/mol
Molecular Formula C17H22I3N3O8
Exact Mass 776.8541 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 700jXyHnCiq
Name S-(-)-(2-HYDROXY-1-OXOPROPYL)-AMINO-N,N'-BIS-[2-HYDROXY-1-(HYDROXYMETHYL)-ETHYL]-2,4,6-TRIIODOISOPHTHALDIAMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22I3N3O8
InChI InChI=1S/C17H22I3N3O8/c1-6(28)15(29)23-14-12(19)9(16(30)21-7(2-24)3-25)11(18)10(13(14)20)17(31)22-8(4-26)5-27/h6-8,24-28H,2-5H2,1H3,(H,21,30)(H,22,31)(H,23,29)
InChIKey XQZXYNRDCRIARQ-UHFFFAOYSA-N
Literature Reference Author S.BRADAMANTE,G.VITTADINI
Literature Reference Citation MAGN.RES.CHEM.,25,283(1987)
Literature Reference DOI 10.1002/mrc.1260250402
Molecular Weight 777.090 g/mol
Solvent DMSO-D6
Source File Reference UNIW22258