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S(-)-N,N'-Bis[2-hydroxy-1-hydroxymethyl-ethyl]-5-[N-(2-hydroxy-1-oxo-propyl)-methylamino]-2,4,6-triiodo-isophthaldiamide
SpectraBase Compound ID 6t5hbqqPoMs
InChI InChI=1S/C18H24I3N3O8/c1-7(29)18(32)24(2)15-13(20)10(16(30)22-8(3-25)4-26)12(19)11(14(15)21)17(31)23-9(5-27)6-28/h7-9,25-29H,3-6H2,1-2H3,(H,22,30)(H,23,31)
InChIKey NVVHQOZXMKTHOM-UHFFFAOYSA-N
Mol Weight 791.12 g/mol
Molecular Formula C18H24I3N3O8
Exact Mass 790.86975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KPnfQvM4RlA
Name S(-)-N,N'-Bis[2-hydroxy-1-hydroxymethyl-ethyl]-5-[N-(2-hydroxy-1-oxo-propyl)-methylamino]-2,4,6-triiodo-isophthaldiamide
CAS Registry Number 129968-27-0
Comments 22 SIGNALS FROM OTHER ISOMERS DETECTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H24I3N3O8
InChI InChI=1S/C18H24I3N3O8/c1-7(29)18(32)24(2)15-13(20)10(16(30)22-8(3-25)4-26)12(19)11(14(15)21)17(31)23-9(5-27)6-28/h7-9,25-29H,3-6H2,1-2H3,(H,22,30)(H,23,31)
InChIKey NVVHQOZXMKTHOM-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference S. Bradamante, G. Vittadini, Magn. Res. Chem. 25, 283 (1987).
NMR Standard TMS Ext.
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O