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2-{2-[3-(N-ethylacetamido)-2,4,6-triiodophenoxy]ethoxy}phenylacetic acid

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2-{2-[3-(N-ethylacetamido)-2,4,6-triiodophenoxy]ethoxy}phenylacetic acid
SpectraBase Compound ID DbXCXJK8ZDk
InChI InChI=1S/C20H20I3NO5/c1-3-24(12(2)25)17-14(21)11-15(22)19(16(17)23)29-10-9-28-18(20(26)27)13-7-5-4-6-8-13/h4-8,11,18H,3,9-10H2,1-2H3,(H,26,27)
InChIKey NXPMMBPFHUCPSN-UHFFFAOYSA-N
Mol Weight 735.1 g/mol
Molecular Formula C20H20I3NO5
Exact Mass 734.847558 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EgpPcYxxPZ2
Name {2-[3-(N-ETHYLACETAMIDO)-2,4,6-TRIIODOPHENOXY]ETHOXY}PHENYLACETIC ACID
Source of Sample E. Felder, Bracco Industria Chimica S.p.A., Milan, Italy
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20I3NO5
InChI InChI=1S/C20H20I3NO5/c1-3-24(12(2)25)17-14(21)11-15(22)19(16(17)23)29-10-9-28-18(20(26)27)13-7-5-4-6-8-13/h4-8,11,18H,3,9-10H2,1-2H3,(H,26,27)
InChIKey NXPMMBPFHUCPSN-UHFFFAOYSA-N
Melting Point 85-90C
Molecular Weight 735.10
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETIC ACID, /2-/3-/N-ETHYLACETAMIDO/-2,4,6-TRIIODOPHENOXY/ETHOXY/PHENYL-,